1-(5,6,7,8,9,10-hexahydrocyclohepta[b]indole-2-sulfonyl)-N-[3-(methylsulfanyl)phenyl]piperidine-4-carboxamide
Chemical Structure Depiction of
1-(5,6,7,8,9,10-hexahydrocyclohepta[b]indole-2-sulfonyl)-N-[3-(methylsulfanyl)phenyl]piperidine-4-carboxamide
1-(5,6,7,8,9,10-hexahydrocyclohepta[b]indole-2-sulfonyl)-N-[3-(methylsulfanyl)phenyl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | G008-0742 |
| Compound Name: | 1-(5,6,7,8,9,10-hexahydrocyclohepta[b]indole-2-sulfonyl)-N-[3-(methylsulfanyl)phenyl]piperidine-4-carboxamide |
| Molecular Weight: | 497.68 |
| Molecular Formula: | C26 H31 N3 O3 S2 |
| Smiles: | CSc1cccc(c1)NC(C1CCN(CC1)S(c1ccc2c(c1)c1CCCCCc1[nH]2)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5122 |
| logD: | 4.5122 |
| logSw: | -4.1721 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.142 |
| InChI Key: | XAWCJBIEJSPAJZ-UHFFFAOYSA-N |