N-{6-[4-(benzenesulfonyl)-1,4-diazepan-1-yl]pyridin-3-yl}-2-(4-chlorophenoxy)acetamide
Chemical Structure Depiction of
N-{6-[4-(benzenesulfonyl)-1,4-diazepan-1-yl]pyridin-3-yl}-2-(4-chlorophenoxy)acetamide
N-{6-[4-(benzenesulfonyl)-1,4-diazepan-1-yl]pyridin-3-yl}-2-(4-chlorophenoxy)acetamide
Compound characteristics
| Compound ID: | V016-0047 |
| Compound Name: | N-{6-[4-(benzenesulfonyl)-1,4-diazepan-1-yl]pyridin-3-yl}-2-(4-chlorophenoxy)acetamide |
| Molecular Weight: | 501 |
| Molecular Formula: | C24 H25 Cl N4 O4 S |
| Salt: | not_available |
| Smiles: | C1CN(CCN(C1)S(c1ccccc1)(=O)=O)c1ccc(cn1)NC(COc1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.6114 |
| logD: | 4.6109 |
| logSw: | -4.8579 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.519 |
| InChI Key: | YKFBRPGHFKGWJF-UHFFFAOYSA-N |