N-[3-(azepan-1-yl)propyl]-5-{[(3-methylphenyl)methanesulfonyl]methyl}furan-2-carboxamide
Chemical Structure Depiction of
N-[3-(azepan-1-yl)propyl]-5-{[(3-methylphenyl)methanesulfonyl]methyl}furan-2-carboxamide
N-[3-(azepan-1-yl)propyl]-5-{[(3-methylphenyl)methanesulfonyl]methyl}furan-2-carboxamide
Compound characteristics
| Compound ID: | K788-6241 |
| Compound Name: | N-[3-(azepan-1-yl)propyl]-5-{[(3-methylphenyl)methanesulfonyl]methyl}furan-2-carboxamide |
| Molecular Weight: | 432.58 |
| Molecular Formula: | C23 H32 N2 O4 S |
| Smiles: | Cc1cccc(CS(Cc2ccc(C(NCCCN3CCCCCC3)=O)o2)(=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.4143 |
| logD: | 0.8437 |
| logSw: | -3.6268 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.677 |
| InChI Key: | AJHNODFXMDOGCL-UHFFFAOYSA-N |