2-{[2-(2,4-dimethylphenyl)-2-oxoethyl]sulfanyl}-N-(2-methoxyethyl)-3-(3-methylbutyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Chemical Structure Depiction of
2-{[2-(2,4-dimethylphenyl)-2-oxoethyl]sulfanyl}-N-(2-methoxyethyl)-3-(3-methylbutyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide
2-{[2-(2,4-dimethylphenyl)-2-oxoethyl]sulfanyl}-N-(2-methoxyethyl)-3-(3-methylbutyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | F067-1300 |
| Compound Name: | 2-{[2-(2,4-dimethylphenyl)-2-oxoethyl]sulfanyl}-N-(2-methoxyethyl)-3-(3-methylbutyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide |
| Molecular Weight: | 495.64 |
| Molecular Formula: | C27 H33 N3 O4 S |
| Smiles: | CC(C)CCN1C(=Nc2cc(ccc2C1=O)C(NCCOC)=O)SCC(c1ccc(C)cc1C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6996 |
| logD: | 4.6996 |
| logSw: | -4.265 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.137 |
| InChI Key: | YSRNKWNVIKZBQL-UHFFFAOYSA-N |