N-[3-(azepan-1-yl)propyl]-3-[(4-chlorophenyl)sulfanyl]-6-methoxy-1H-indole-2-carboxamide
Chemical Structure Depiction of
N-[3-(azepan-1-yl)propyl]-3-[(4-chlorophenyl)sulfanyl]-6-methoxy-1H-indole-2-carboxamide
N-[3-(azepan-1-yl)propyl]-3-[(4-chlorophenyl)sulfanyl]-6-methoxy-1H-indole-2-carboxamide
Compound characteristics
| Compound ID: | E018-2450 |
| Compound Name: | N-[3-(azepan-1-yl)propyl]-3-[(4-chlorophenyl)sulfanyl]-6-methoxy-1H-indole-2-carboxamide |
| Molecular Weight: | 472.05 |
| Molecular Formula: | C25 H30 Cl N3 O2 S |
| Smiles: | COc1ccc2c(c(C(NCCCN3CCCCCC3)=O)[nH]c2c1)Sc1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.5032 |
| logD: | 2.9326 |
| logSw: | -5.9627 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 46.199 |
| InChI Key: | DFDRCMJIFVGQBJ-UHFFFAOYSA-N |