ethyl 2-{[3-(3,5-dimethylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}pentanoate
Chemical Structure Depiction of
ethyl 2-{[3-(3,5-dimethylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}pentanoate
ethyl 2-{[3-(3,5-dimethylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}pentanoate
Compound characteristics
| Compound ID: | V014-2619 |
| Compound Name: | ethyl 2-{[3-(3,5-dimethylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}pentanoate |
| Molecular Weight: | 410.53 |
| Molecular Formula: | C23 H26 N2 O3 S |
| Smiles: | CCCC(C(=O)OCC)SC1=Nc2ccccc2C(N1c1cc(C)cc(C)c1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4068 |
| logD: | 5.4066 |
| logSw: | -5.4651 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 46.185 |
| InChI Key: | MOBODFVPQMMUQG-FQEVSTJZSA-N |