benzyl (3-{3-[(4-methylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)carbamate
Chemical Structure Depiction of
benzyl (3-{3-[(4-methylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)carbamate
benzyl (3-{3-[(4-methylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)carbamate
Compound characteristics
Compound ID: | V020-2885 |
Compound Name: | benzyl (3-{3-[(4-methylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)carbamate |
Molecular Weight: | 429.52 |
Molecular Formula: | C26 H27 N3 O3 |
Smiles: | Cc1ccc(CN2CCCN(C2=O)c2cccc(c2)NC(=O)OCc2ccccc2)cc1 |
Stereo: | ACHIRAL |
logP: | 5.6213 |
logD: | 5.6212 |
logSw: | -5.294 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 51.345 |
InChI Key: | LRDRSDJRPXSKGC-UHFFFAOYSA-N |