2-{[(3-chlorophenyl)methyl]sulfanyl}-3-(3,5-dimethylphenyl)-N-(2-methoxyethyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Chemical Structure Depiction of
2-{[(3-chlorophenyl)methyl]sulfanyl}-3-(3,5-dimethylphenyl)-N-(2-methoxyethyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide
2-{[(3-chlorophenyl)methyl]sulfanyl}-3-(3,5-dimethylphenyl)-N-(2-methoxyethyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | G858-0114 |
| Compound Name: | 2-{[(3-chlorophenyl)methyl]sulfanyl}-3-(3,5-dimethylphenyl)-N-(2-methoxyethyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide |
| Molecular Weight: | 508.04 |
| Molecular Formula: | C27 H26 Cl N3 O3 S |
| Smiles: | Cc1cc(C)cc(c1)N1C(=Nc2cc(ccc2C1=O)C(NCCOC)=O)SCc1cccc(c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.1778 |
| logD: | 5.1769 |
| logSw: | -5.4002 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.028 |
| InChI Key: | QYTUJTSTEBBNAN-UHFFFAOYSA-N |