N-[6-(4-benzoyl-1,4-diazepan-1-yl)pyridin-3-yl]-N'-(4-methoxyphenyl)urea
Chemical Structure Depiction of
N-[6-(4-benzoyl-1,4-diazepan-1-yl)pyridin-3-yl]-N'-(4-methoxyphenyl)urea
N-[6-(4-benzoyl-1,4-diazepan-1-yl)pyridin-3-yl]-N'-(4-methoxyphenyl)urea
Compound characteristics
| Compound ID: | V025-2444 |
| Compound Name: | N-[6-(4-benzoyl-1,4-diazepan-1-yl)pyridin-3-yl]-N'-(4-methoxyphenyl)urea |
| Molecular Weight: | 445.52 |
| Molecular Formula: | C25 H27 N5 O3 |
| Salt: | not_available |
| Smiles: | COc1ccc(cc1)NC(Nc1ccc(nc1)N1CCCN(CC1)C(c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.467 |
| logD: | 4.4669 |
| logSw: | -4.0568 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.926 |
| InChI Key: | JWRFNXSIKVJNAB-UHFFFAOYSA-N |