N-{6-[4-(2-chlorobenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}-3-fluorobenzamide
Chemical Structure Depiction of
N-{6-[4-(2-chlorobenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}-3-fluorobenzamide
N-{6-[4-(2-chlorobenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}-3-fluorobenzamide
Compound characteristics
| Compound ID: | V013-3553 |
| Compound Name: | N-{6-[4-(2-chlorobenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}-3-fluorobenzamide |
| Molecular Weight: | 452.91 |
| Molecular Formula: | C24 H22 Cl F N4 O2 |
| Smiles: | C1CN(CCN(C1)c1ccc(cn1)NC(c1cccc(c1)F)=O)C(c1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.4758 |
| logD: | 4.4736 |
| logSw: | -4.4748 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.17 |
| InChI Key: | VZPIAIBBNKJDGK-UHFFFAOYSA-N |