N-{[2-(azepan-1-yl)pyridin-4-yl]methyl}-N'-(2,5-dimethylphenyl)urea
Chemical Structure Depiction of
N-{[2-(azepan-1-yl)pyridin-4-yl]methyl}-N'-(2,5-dimethylphenyl)urea
N-{[2-(azepan-1-yl)pyridin-4-yl]methyl}-N'-(2,5-dimethylphenyl)urea
Compound characteristics
Compound ID: | L585-0405 |
Compound Name: | N-{[2-(azepan-1-yl)pyridin-4-yl]methyl}-N'-(2,5-dimethylphenyl)urea |
Molecular Weight: | 352.48 |
Molecular Formula: | C21 H28 N4 O |
Smiles: | Cc1ccc(C)c(c1)NC(NCc1ccnc(c1)N1CCCCCC1)=O |
Stereo: | ACHIRAL |
logP: | 3.9896 |
logD: | 3.9858 |
logSw: | -3.966 |
Hydrogen bond acceptors count: | 3 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 45.46 |
InChI Key: | LEGAZBBXNNGIDY-UHFFFAOYSA-N |