N-(3-fluoro-4-methylphenyl)-N'-(6-{4-[4-(trifluoromethyl)benzoyl]-1,4-diazepan-1-yl}pyridin-3-yl)urea
Chemical Structure Depiction of
N-(3-fluoro-4-methylphenyl)-N'-(6-{4-[4-(trifluoromethyl)benzoyl]-1,4-diazepan-1-yl}pyridin-3-yl)urea
N-(3-fluoro-4-methylphenyl)-N'-(6-{4-[4-(trifluoromethyl)benzoyl]-1,4-diazepan-1-yl}pyridin-3-yl)urea
Compound characteristics
| Compound ID: | V021-6239 |
| Compound Name: | N-(3-fluoro-4-methylphenyl)-N'-(6-{4-[4-(trifluoromethyl)benzoyl]-1,4-diazepan-1-yl}pyridin-3-yl)urea |
| Molecular Weight: | 515.51 |
| Molecular Formula: | C26 H25 F4 N5 O2 |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1F)NC(Nc1ccc(nc1)N1CCCN(CC1)C(c1ccc(cc1)C(F)(F)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.1122 |
| logD: | 6.1121 |
| logSw: | -5.3539 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.382 |
| InChI Key: | MPBYPHPFYCTISP-UHFFFAOYSA-N |