N-{6-[4-(2,4-dichlorobenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}-2,4-difluorobenzamide
Chemical Structure Depiction of
N-{6-[4-(2,4-dichlorobenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}-2,4-difluorobenzamide
N-{6-[4-(2,4-dichlorobenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}-2,4-difluorobenzamide
Compound characteristics
| Compound ID: | V013-9831 |
| Compound Name: | N-{6-[4-(2,4-dichlorobenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}-2,4-difluorobenzamide |
| Molecular Weight: | 505.35 |
| Molecular Formula: | C24 H20 Cl2 F2 N4 O2 |
| Salt: | not_available |
| Smiles: | C1CN(CCN(C1)c1ccc(cn1)NC(c1ccc(cc1F)F)=O)C(c1ccc(cc1[Cl])[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.3776 |
| logD: | 5.358 |
| logSw: | -6.029 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.17 |
| InChI Key: | UDCZXRRDVPRSBB-UHFFFAOYSA-N |