ethyl 2-{[3-(2-methylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}pentanoate
Chemical Structure Depiction of
ethyl 2-{[3-(2-methylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}pentanoate
ethyl 2-{[3-(2-methylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}pentanoate
Compound characteristics
| Compound ID: | V005-2662 |
| Compound Name: | ethyl 2-{[3-(2-methylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}pentanoate |
| Molecular Weight: | 396.51 |
| Molecular Formula: | C22 H24 N2 O3 S |
| Smiles: | CCCC(C(=O)OCC)SC1=Nc2ccccc2C(N1c1ccccc1C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7997 |
| logD: | 4.7996 |
| logSw: | -4.6174 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 45.884 |
| InChI Key: | SAQGHHRYWDDSRI-IBGZPJMESA-N |