N-{6-[4-(4-methylbenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}-N'-(2-methylphenyl)urea
Chemical Structure Depiction of
N-{6-[4-(4-methylbenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}-N'-(2-methylphenyl)urea
N-{6-[4-(4-methylbenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}-N'-(2-methylphenyl)urea
Compound characteristics
| Compound ID: | V022-9993 |
| Compound Name: | N-{6-[4-(4-methylbenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}-N'-(2-methylphenyl)urea |
| Molecular Weight: | 443.55 |
| Molecular Formula: | C26 H29 N5 O2 |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)C(N1CCCN(CC1)c1ccc(cn1)NC(Nc1ccccc1C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8089 |
| logD: | 4.8088 |
| logSw: | -4.3459 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.684 |
| InChI Key: | PPAXRIMSEHZPCJ-UHFFFAOYSA-N |