Triamterene

Compound Structure

CAS Number: 396-01-0

Molecular Mass: 253.26 g/mol

Formula: C12H11N7

Smiles: Nc1nc(N)c2nc(-c3ccccc3)c(N)nc2n1

Synonymes:

Bioactivity: -

Solubility in Different Solvents

Solvent Temperature [K] Crystal form Solubility [mg/mL] Reference
1,2-Dichloroethane 283.15 - 0.0056 [431]
1,2-Dichloroethane 288.15 - 0.0075 [431]
1,2-Dichloroethane 293.15 - 0.0113 [431]
1,2-Dichloroethane 298.15 - 0.01669 [431]
1,2-Dichloroethane 303.15 - 0.0239 [431]
1,2-Dichloroethane 308.15 - 0.0337 [431]
1,2-Dichloroethane 313.15 - 0.0532 [431]
1,2-Dichloroethane 318.15 - 0.074 [431]
1,2-Dichloroethane 323.15 - 0.1099 [431]
1-Butanol 283.15 - 0.00926 [431]
1-Butanol 288.15 - 0.0148 [431]
1-Butanol 293.15 - 0.0224 [431]
1-Butanol 298.15 - 0.0317 [431]
1-Butanol 303.15 - 0.044 [431]
1-Butanol 308.15 - 0.0574 [431]
1-Butanol 313.15 - 0.08439 [431]
1-Butanol 318.15 - 0.1168 [431]
1-Butanol 323.15 - 0.1742 [431]
1-Propanol 283.15 - 0.01449 [431]
1-Propanol 288.15 - 0.0208 [431]
1-Propanol 293.15 - 0.0309 [431]
1-Propanol 298.15 - 0.0483 [431]
1-Propanol 303.15 - 0.0679 [431]
1-Propanol 308.15 - 0.0941 [431]
1-Propanol 313.15 - 0.1286 [431]
1-Propanol 318.15 - 0.1748 [431]
1-Propanol 323.15 - 0.231 [431]
2-Methoxyethanol 283.15 - 6.122 [431]
2-Methoxyethanol 288.15 - 8.028 [431]
2-Methoxyethanol 293.15 - 10.88 [431]
2-Methoxyethanol 298.15 - 14.57 [431]
2-Methoxyethanol 303.15 - 19.37 [431]
2-Methoxyethanol 308.15 - 25.28 [431]
2-Methoxyethanol 313.15 - 33.68 [431]
2-Methoxyethanol 318.15 - 44.46 [431]
2-Methoxyethanol 323.15 - 57.32 [431]
Acetonitrile 283.15 - 0.01233 [431]
Acetonitrile 288.15 - 0.01669 [431]
Acetonitrile 293.15 - 0.0249 [431]
Acetonitrile 298.15 - 0.0383 [431]
Acetonitrile 303.15 - 0.055 [431]
Acetonitrile 308.15 - 0.0758 [431]
Acetonitrile 313.15 - 0.1139 [431]
Acetonitrile 318.15 - 0.1618 [431]
Acetonitrile 323.15 - 0.2309 [431]
Dimethyl sulfoxide 293.15 - 7.202 [431]
Dimethyl sulfoxide 298.15 - 10.02 [431]
Dimethyl sulfoxide 303.15 - 13.51 [431]
Dimethyl sulfoxide 308.15 - 18.11 [431]
Dimethyl sulfoxide 313.15 - 23.99 [431]
Dimethyl sulfoxide 318.15 - 31.69 [431]
Dimethyl sulfoxide 323.15 - 41.47 [431]
Ethyl acetate 283.15 - 0.0076 [431]
Ethyl acetate 288.15 - 0.0118 [431]
Ethyl acetate 293.15 - 0.0189 [431]
Ethyl acetate 298.15 - 0.0243 [431]
Ethyl acetate 303.15 - 0.0363 [431]
Ethyl acetate 308.15 - 0.0494 [431]
Ethyl acetate 313.15 - 0.0705 [431]
Ethyl acetate 318.15 - 0.09949 [431]
Ethyl acetate 323.15 - 0.1512 [431]
Isobutanol 283.15 - 0.008 [431]
Isobutanol 288.15 - 0.0111 [431]
Isobutanol 293.15 - 0.0168 [431]
Isobutanol 298.15 - 0.0238 [431]
Isobutanol 303.15 - 0.03338 [431]
Isobutanol 308.15 - 0.04604 [431]
Isobutanol 313.15 - 0.0686 [431]
Isobutanol 318.15 - 0.1012 [431]
Isobutanol 323.15 - 0.1443 [431]
Isopropanol 283.15 - 0.0068 [431]
Isopropanol 288.15 - 0.0118 [431]
Isopropanol 293.15 - 0.0163 [431]
Isopropanol 298.15 - 0.0244 [431]
Isopropanol 303.15 - 0.0346 [431]
Isopropanol 308.15 - 0.04797 [431]
Isopropanol 313.15 - 0.0675 [431]
Isopropanol 318.15 - 0.0945 [431]
Isopropanol 323.15 - 0.134 [431]
Methanol 283.15 - 0.1838 [431]
Methanol 288.15 - 0.2712 [431]
Methanol 293.15 - 0.3977 [431]
Methanol 298.15 - 0.5236 [431]
Methanol 303.15 - 0.7859 [431]
Methanol 308.15 - 1.036 [431]
Methanol 313.15 - 1.463 [431]
Methanol 318.15 - 1.942 [431]
Methanol 323.15 - 2.709 [431]
Water 283.15 - 0.0151 [431]
Water 288.15 - 0.0181 [431]
Water 293.15 - 0.0211 [431]
Water 298.15 - 0.0251 [431]
Water 303.15 - 0.0302 [431]
Water 308.15 - 0.0369 [431]
Water 313.15 - 0.04359 [431]
Water 318.15 - 0.0523 [431]
Water 323.15 - 0.064 [431]

Molecule 3D descriptors

Descriptor Value
PMI1 530.2851
PMI2 2382.9013
PMI3 2834.3851
NPR1 0.1871
NPR2 0.8407
RadiusOfGyration 3.3685
InertialShapeFactor 0.0016
Eccentricity 0.9823
Asphericity 0.5415
SpherocityIndex 0.0803
PBF 0.4494