benzyl (2-{3-[(2,5-dimethylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}-5-methylphenyl)carbamate
Chemical Structure Depiction of
benzyl (2-{3-[(2,5-dimethylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}-5-methylphenyl)carbamate
benzyl (2-{3-[(2,5-dimethylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}-5-methylphenyl)carbamate
Compound characteristics
| Compound ID: | V015-5076 |
| Compound Name: | benzyl (2-{3-[(2,5-dimethylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}-5-methylphenyl)carbamate |
| Molecular Weight: | 457.57 |
| Molecular Formula: | C28 H31 N3 O3 |
| Smiles: | Cc1ccc(C)c(CN2CCCN(C2=O)c2ccc(C)cc2NC(=O)OCc2ccccc2)c1 |
| Stereo: | ACHIRAL |
| logP: | 6.6277 |
| logD: | 6.6273 |
| logSw: | -5.5647 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.346 |
| InChI Key: | LQALZPZPXBBXSH-UHFFFAOYSA-N |