N-(6-{4-[(2,4-difluorophenyl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)-N'-(4-methoxyphenyl)urea
Chemical Structure Depiction of
N-(6-{4-[(2,4-difluorophenyl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)-N'-(4-methoxyphenyl)urea
N-(6-{4-[(2,4-difluorophenyl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)-N'-(4-methoxyphenyl)urea
Compound characteristics
| Compound ID: | V029-7181 |
| Compound Name: | N-(6-{4-[(2,4-difluorophenyl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)-N'-(4-methoxyphenyl)urea |
| Molecular Weight: | 467.52 |
| Molecular Formula: | C25 H27 F2 N5 O2 |
| Salt: | not_available |
| Smiles: | COc1ccc(cc1)NC(Nc1ccc(nc1)N1CCCN(CC1)Cc1ccc(cc1F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4369 |
| logD: | 5.4009 |
| logSw: | -5.2117 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.01 |
| InChI Key: | BUBXLZOZILIYCA-UHFFFAOYSA-N |