N-butyl-3-[(4-chlorophenyl)sulfanyl]-N-methyl-1H-indole-2-carboxamide
Chemical Structure Depiction of
N-butyl-3-[(4-chlorophenyl)sulfanyl]-N-methyl-1H-indole-2-carboxamide
N-butyl-3-[(4-chlorophenyl)sulfanyl]-N-methyl-1H-indole-2-carboxamide
Compound characteristics
| Compound ID: | E018-0627 |
| Compound Name: | N-butyl-3-[(4-chlorophenyl)sulfanyl]-N-methyl-1H-indole-2-carboxamide |
| Molecular Weight: | 372.92 |
| Molecular Formula: | C20 H21 Cl N2 O S |
| Smiles: | CCCCN(C)C(c1c(c2ccccc2[nH]1)Sc1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.066 |
| logD: | 5.066 |
| logSw: | -5.1331 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 26.4868 |
| InChI Key: | ALUHUPXQEODFCN-UHFFFAOYSA-N |