N-[5-methyl-2-(2-oxo-3-{[4-(propan-2-yl)phenyl]methyl}-1,3-diazinan-1-yl)phenyl]thiophene-2-carboxamide
Chemical Structure Depiction of
N-[5-methyl-2-(2-oxo-3-{[4-(propan-2-yl)phenyl]methyl}-1,3-diazinan-1-yl)phenyl]thiophene-2-carboxamide
N-[5-methyl-2-(2-oxo-3-{[4-(propan-2-yl)phenyl]methyl}-1,3-diazinan-1-yl)phenyl]thiophene-2-carboxamide
Compound characteristics
| Compound ID: | V018-8852 |
| Compound Name: | N-[5-methyl-2-(2-oxo-3-{[4-(propan-2-yl)phenyl]methyl}-1,3-diazinan-1-yl)phenyl]thiophene-2-carboxamide |
| Molecular Weight: | 447.6 |
| Molecular Formula: | C26 H29 N3 O2 S |
| Smiles: | CC(C)c1ccc(CN2CCCN(C2=O)c2ccc(C)cc2NC(c2cccs2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.8902 |
| logD: | 5.8898 |
| logSw: | -5.3716 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.908 |
| InChI Key: | PRSMAMJLKBFNFJ-UHFFFAOYSA-N |