benzyl (4-{3-[(3,4-dichlorophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)carbamate
Chemical Structure Depiction of
benzyl (4-{3-[(3,4-dichlorophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)carbamate
benzyl (4-{3-[(3,4-dichlorophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)carbamate
Compound characteristics
Compound ID: | V021-4498 |
Compound Name: | benzyl (4-{3-[(3,4-dichlorophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)carbamate |
Molecular Weight: | 484.38 |
Molecular Formula: | C25 H23 Cl2 N3 O3 |
Smiles: | C1CN(Cc2ccc(c(c2)[Cl])[Cl])C(N(C1)c1ccc(cc1)NC(=O)OCc1ccccc1)=O |
Stereo: | ACHIRAL |
logP: | 6.3041 |
logD: | 6.304 |
logSw: | -6.3344 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 51.345 |
InChI Key: | JVRXMOLBZYJGKN-UHFFFAOYSA-N |