4-(1-ethyl-1H-indole-5-sulfonyl)-N-[3-(methylsulfanyl)phenyl]-1,4-diazepane-1-carboxamide
Chemical Structure Depiction of
4-(1-ethyl-1H-indole-5-sulfonyl)-N-[3-(methylsulfanyl)phenyl]-1,4-diazepane-1-carboxamide
4-(1-ethyl-1H-indole-5-sulfonyl)-N-[3-(methylsulfanyl)phenyl]-1,4-diazepane-1-carboxamide
Compound characteristics
| Compound ID: | G589-0446 |
| Compound Name: | 4-(1-ethyl-1H-indole-5-sulfonyl)-N-[3-(methylsulfanyl)phenyl]-1,4-diazepane-1-carboxamide |
| Molecular Weight: | 472.63 |
| Molecular Formula: | C23 H28 N4 O3 S2 |
| Smiles: | CCn1ccc2cc(ccc12)S(N1CCCN(CC1)C(Nc1cccc(c1)SC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7031 |
| logD: | 3.7031 |
| logSw: | -3.7714 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.393 |
| InChI Key: | RTNUIBZRNLJXJC-UHFFFAOYSA-N |