N-(3-chloro-4-fluorophenyl)-N'-{6-[4-(2,4-difluorobenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}urea
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-N'-{6-[4-(2,4-difluorobenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}urea
N-(3-chloro-4-fluorophenyl)-N'-{6-[4-(2,4-difluorobenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}urea
Compound characteristics
| Compound ID: | V023-4757 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-N'-{6-[4-(2,4-difluorobenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}urea |
| Molecular Weight: | 503.91 |
| Molecular Formula: | C24 H21 Cl F3 N5 O2 |
| Salt: | not_available |
| Smiles: | C1CN(CCN(C1)c1ccc(cn1)NC(Nc1ccc(c(c1)[Cl])F)=O)C(c1ccc(cc1F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7766 |
| logD: | 5.7734 |
| logSw: | -6.0722 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.382 |
| InChI Key: | BHPHASLCFVTLJY-UHFFFAOYSA-N |