N-(3-methylbutyl)-3-[(4-methylphenyl)sulfanyl]-1H-indole-2-carboxamide
Chemical Structure Depiction of
N-(3-methylbutyl)-3-[(4-methylphenyl)sulfanyl]-1H-indole-2-carboxamide
N-(3-methylbutyl)-3-[(4-methylphenyl)sulfanyl]-1H-indole-2-carboxamide
Compound characteristics
| Compound ID: | E018-0434 |
| Compound Name: | N-(3-methylbutyl)-3-[(4-methylphenyl)sulfanyl]-1H-indole-2-carboxamide |
| Molecular Weight: | 352.5 |
| Molecular Formula: | C21 H24 N2 O S |
| Smiles: | CC(C)CCNC(c1c(c2ccccc2[nH]1)Sc1ccc(C)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2931 |
| logD: | 5.2931 |
| logSw: | -5.4485 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 34.613 |
| InChI Key: | AQKRSDNBWZUMPT-UHFFFAOYSA-N |