N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]-2-[(5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]butanamide
Chemical Structure Depiction of
N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]-2-[(5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]butanamide
N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]-2-[(5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]butanamide
Compound characteristics
| Compound ID: | 6623-1147 |
| Compound Name: | N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]-2-[(5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]butanamide |
| Molecular Weight: | 413.52 |
| Molecular Formula: | C18 H19 N7 O S2 |
| Smiles: | CCC(C(Nc1nnc(C(C)C)s1)=O)Sc1nc2c(c3ccccc3[nH]2)nn1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8058 |
| logD: | 3.6885 |
| logSw: | -4.0727 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.442 |
| InChI Key: | DGJHGTDELQHSKF-LBPRGKRZSA-N |