5-iodo-2′-deoxyuridine
CAS Number: 54-42-2
Molecular Mass: 354.1 g/mol
Formula: C9H11IN2O5
Smiles: O=c1[nH]c(=O)n([C@H]2C[C@H](O)[C@@H](CO)O2)cc1I
Synonymes:
5-iodo-2′-deoxyuridine, idoxuridine, 5-Iodo-2'-deoxyuridine, 54-42-2, 5-Iododeoxyuridine, Idoxuridin, Herplex, Stoxil, 2'-Deoxy-5-iodouridine, Iododeoxyridine, Iodoxuridine, Joddeoxiuridin, IUDR, 5IUDR, IDUR, Iduridin, Idoxene, Kerecid, (+)-5-Iodo-2'-deoxyuridine, Virudox, Dendrid, Iododeoxyuridine, URIDINE, 2'-DEOXY-5-IODO-, Idoxuridina, Idoxuridinum, 5-Iodouracil deoxyriboside, IdUrd, 5-IUDR, Ophthalmadine, Emanil, Idexur, Idulea, Allergan-211, 1-(2-Deoxy-beta-D-ribofuranosyl)-5-iodouracil, NSC-39661, SK&F-14287, SK&F 14287, 1beta-D-2'-Deoxyribofuranosyl-5-iodouracil, 1-beta-D-2'-Deoxyribofuranosyl-5-iodouracil, DTXSID2045238, ALLERGAN211, CHEBI:147675, LGP81V5245, NSC 39661, Uracil, 5-iodo-1-(2-deoxy-beta-D-ribofuranosyl)-, DTXCID0025238, SKF 14287, NSC39661, OftanIDU, 5 Iododeoxyuridine, Oftan IDU, Liquifilm, Herplex, 1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-iodo-1,2,3,4-tetrahydropyrimidine-2,4-dione, 3H-Labeled Idoxuridine, Idoxuridine, 3H Labeled, 5 Iodo 2' deoxyuridine, 123I-Labeled Idoxuridine, 125I-Labeled Idoxuridine, 131I-Labeled Idoxuridine, Idoxuridine, 123I Labeled, Idoxuridine, 125I Labeled, Idoxuridine, 131I Labeled, 1-((2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl)-5-iodo-1,2,3,4-tetrahydropyrimidine-2,4-dione, RefChem:55392, D06BB01, J05AB02, S01AD01, 200-207-8, Allergan 211, Allergan 201, Idossuridina [DCIT], IDU, C9H11IN2O5, 5IdU, MFCD00134656, 1-((2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)-5-iodopyrimidine-2,4(1H,3H)-dione, 1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-iodopyrimidine-2,4-dione, Antizona, Heratil, 5-Iodo-deoxyuridine, ID2, Iduoculos, Idoxuridinum [INN-Latin], Idoxuridina [INN-Spanish], Idossuridina, 5-Iododesoxyuridine, 1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-5-iodo-pyrimidine-2,4-dione, CCRIS 2827, 1-(2-Deoxy-b-D-ribofuranosyl)-5-iodouracil, 2'-Deoxy-L-5-iodouridine, SR-05000001510, 2'-Deoxy-5-iodo-D-uridine, 5-lodo-2'-Deoxyuridine, EINECS 200-207-8, BRN 0030397, UNII-LGP81V5245, AI3-50861, Idoxuridine CRS, HSDB 7479, CAS-54-42-2, NCGC00016243-01, 162239-35-2, Dendrid (TN), Idoxuridine [USAN:USP:INN:BAN:JAN], 5-iodo-2'deoxyuridine, HERPLEX (TN), IDOXURIDINE [MI], 5-IdU, Prestwick3_000018, IDOXURIDINE [INN], IDOXURIDINE [JAN], IDOXURIDINE [HSDB], CHEMBL788, Epitope ID:138107, IDOXURIDINE [VANDF], 5-I-2'-dUrd, SCHEMBL3683, IDOXURIDINE [MART.], BSPBio_000055, IDOXURIDINE [USP-RS], IDOXURIDINE [WHO-DD], IDOXURIDINE [WHO-IP], 4-24-00-01235 (Beilstein Handbook Reference), MLS002154175, 5-IODO-2-DEOXYURIDINE, BPBio1_000061, orb3032917, SCHEMBL6834964, Idoxuridine (JP18/USP/INN), 2'-Deoxy-5-iodouridine - EP, SCHEMBL10582759, SCHEMBL15850897, 2'-DESOXY-5-IODOURIDINE, IDOXURIDINE [ORANGE BOOK], GLXC-06574, HMS2090M10, HMS2095C17, HMS2230E10, HMS3712C17, IDOXURIDINE [EP MONOGRAPH], IDOXURIDINE [USP IMPURITY], IDOXURIDINE [USP MONOGRAPH], HY-B0307, IDOXURIDINUM [WHO-IP LATIN], 5-IUdR, 5-Iodouracil deoxyriboside, Tox21_110324, BDBM50370388, EBC-26704, MSK169312, s1883, AKOS015920431, Tox21_110324_1, AC-8219, CCG-220018, DB00249, ND05147, SMP2_000072, 5-lodo-2'-deoxycytidine(5-I-2'-dU), NCGC00179673-01, NCGC00179673-03, NCGC00179673-05, AS-13469, BP-58646, ND172114, SMR001233472, SY015040, Idoxuridine 100 microg/mL in Acetonitrile, DB-009133, 5-Iodo-2'-deoxyuridine, >=99% (HPLC), I0258, SW198484-2, 1-(2-Deoxy-ss -D-ribofuranosyl)-5-iodouracil, D00342, 5-iodo-2 inverted exclamation mark -Deoxyuridine, F092965, Q409765, SR-05000001510-1, SR-05000001510-3, SR-05000001510-4, BRD-K76634210-001-12-1, BRD-K76634210-001-14-7, Idoxuridine, European Pharmacopoeia (EP) Reference Standard, Idoxuridine, United States Pharmacopeia (USP) Reference Standard
Bioactivity: -
Solubility in Different Solvents
| Solvent | Temperature [K] | Crystal form | Solubility [mg/mL] | Reference |
|---|---|---|---|---|
| Water | 302.2 | - | 2.54 | [454] |
| Water | 312.6 | - | 4.086 | [454] |
| Water | 317.8 | - | 5.05 | [454] |
| Water | 321.9 | - | 7.56 | [454] |
| Water | 323.0 | - | 5.23 | [454] |
| Water | 326.2 | - | 7.93 | [454] |
| Water | 332.0 | - | 9.84 | [454] |
| Water | 336.0 | - | 9.05 | [454] |
| Water | 343.1 | - | 14.6 | [454] |
| Water | 348.6 | - | 17.1 | [454] |
| Water | 349.8 | - | 19.54 | [454] |
Molecule 3D descriptors
| Descriptor | Value |
|---|---|
| PMI1 | 1026.4068 |
| PMI2 | 2837.4264 |
| PMI3 | 3723.2298 |
| NPR1 | 0.2757 |
| NPR2 | 0.7621 |
| RadiusOfGyration | 3.2731 |
| InertialShapeFactor | 0.0007 |
| Eccentricity | 0.9613 |
| Asphericity | 0.3939 |
| SpherocityIndex | 0.1710 |
| PBF | 0.5901 |