(azepan-1-yl)(5-{[(4-chlorophenyl)methanesulfonyl]methyl}furan-2-yl)methanone
Chemical Structure Depiction of
(azepan-1-yl)(5-{[(4-chlorophenyl)methanesulfonyl]methyl}furan-2-yl)methanone
(azepan-1-yl)(5-{[(4-chlorophenyl)methanesulfonyl]methyl}furan-2-yl)methanone
Compound characteristics
| Compound ID: | K786-3062 |
| Compound Name: | (azepan-1-yl)(5-{[(4-chlorophenyl)methanesulfonyl]methyl}furan-2-yl)methanone |
| Molecular Weight: | 395.9 |
| Molecular Formula: | C19 H22 Cl N O4 S |
| Smiles: | C1CCCN(CC1)C(c1ccc(CS(Cc2ccc(cc2)[Cl])(=O)=O)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4473 |
| logD: | 3.4473 |
| logSw: | -3.7174 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.088 |
| InChI Key: | SHHVLTOKKQRUES-UHFFFAOYSA-N |