7-(2,1,3-benzothiadiazole-4-sulfonyl)-3-cyclopropyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-d][1,4]diazepine
Chemical Structure Depiction of
7-(2,1,3-benzothiadiazole-4-sulfonyl)-3-cyclopropyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-d][1,4]diazepine
7-(2,1,3-benzothiadiazole-4-sulfonyl)-3-cyclopropyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-d][1,4]diazepine
Compound characteristics
| Compound ID: | S584-0354 |
| Compound Name: | 7-(2,1,3-benzothiadiazole-4-sulfonyl)-3-cyclopropyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-d][1,4]diazepine |
| Molecular Weight: | 376.46 |
| Molecular Formula: | C15 H16 N6 O2 S2 |
| Smiles: | C1CN(CCn2c1nnc2C1CC1)S(c1cccc2c1nsn2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6425 |
| logD: | 1.5538 |
| logSw: | -2.0951 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 78.257 |
| InChI Key: | YQJVSGHNTXIRTL-UHFFFAOYSA-N |