ethyl 2-{[3-(5-chloro-2-methylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}pentanoate
Chemical Structure Depiction of
ethyl 2-{[3-(5-chloro-2-methylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}pentanoate
ethyl 2-{[3-(5-chloro-2-methylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}pentanoate
Compound characteristics
| Compound ID: | V005-1468 |
| Compound Name: | ethyl 2-{[3-(5-chloro-2-methylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}pentanoate |
| Molecular Weight: | 430.95 |
| Molecular Formula: | C22 H23 Cl N2 O3 S |
| Smiles: | CCCC(C(=O)OCC)SC1=Nc2ccccc2C(N1c1cc(ccc1C)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.5315 |
| logD: | 5.5315 |
| logSw: | -5.7774 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 45.884 |
| InChI Key: | SMTAWVROBCUWNY-IBGZPJMESA-N |