tert-butyl {[3-(2-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetate
Chemical Structure Depiction of
tert-butyl {[3-(2-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetate
tert-butyl {[3-(2-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetate
Compound characteristics
| Compound ID: | V011-0616 |
| Compound Name: | tert-butyl {[3-(2-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetate |
| Molecular Weight: | 398.48 |
| Molecular Formula: | C21 H22 N2 O4 S |
| Smiles: | CC(C)(C)OC(CSC1=Nc2ccccc2C(N1c1ccccc1OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5693 |
| logD: | 3.569 |
| logSw: | -3.9054 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 52.029 |
| InChI Key: | TXLRWFQHRILRLY-UHFFFAOYSA-N |