2-cyclopentyl-9-methyl-N-[3-(methylsulfanyl)phenyl]-1-oxo-2,9-dihydro-1H-pyrido[3,4-b]indole-4-carboxamide
Chemical Structure Depiction of
2-cyclopentyl-9-methyl-N-[3-(methylsulfanyl)phenyl]-1-oxo-2,9-dihydro-1H-pyrido[3,4-b]indole-4-carboxamide
2-cyclopentyl-9-methyl-N-[3-(methylsulfanyl)phenyl]-1-oxo-2,9-dihydro-1H-pyrido[3,4-b]indole-4-carboxamide
Compound characteristics
| Compound ID: | C329-0440 |
| Compound Name: | 2-cyclopentyl-9-methyl-N-[3-(methylsulfanyl)phenyl]-1-oxo-2,9-dihydro-1H-pyrido[3,4-b]indole-4-carboxamide |
| Molecular Weight: | 431.56 |
| Molecular Formula: | C25 H25 N3 O2 S |
| Smiles: | Cn1c2C(N(C=C(C(Nc3cccc(c3)SC)=O)c2c2ccccc12)C1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2717 |
| logD: | 4.2713 |
| logSw: | -4.4683 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.968 |
| InChI Key: | XCXDRHZJFBKYTH-UHFFFAOYSA-N |