benzyl (3-{3-[(3,5-dimethylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)carbamate
Chemical Structure Depiction of
benzyl (3-{3-[(3,5-dimethylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)carbamate
benzyl (3-{3-[(3,5-dimethylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)carbamate
Compound characteristics
| Compound ID: | V019-6110 |
| Compound Name: | benzyl (3-{3-[(3,5-dimethylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)carbamate |
| Molecular Weight: | 443.55 |
| Molecular Formula: | C27 H29 N3 O3 |
| Smiles: | Cc1cc(C)cc(CN2CCCN(C2=O)c2cccc(c2)NC(=O)OCc2ccccc2)c1 |
| Stereo: | ACHIRAL |
| logP: | 6.4771 |
| logD: | 6.477 |
| logSw: | -5.5651 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.345 |
| InChI Key: | BGVNAODEAXVWQE-UHFFFAOYSA-N |