N-(3-chloro-4-methoxyphenyl)-2-{[4-oxo-6-phenyl-3-(prop-2-en-1-yl)-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(3-chloro-4-methoxyphenyl)-2-{[4-oxo-6-phenyl-3-(prop-2-en-1-yl)-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
N-(3-chloro-4-methoxyphenyl)-2-{[4-oxo-6-phenyl-3-(prop-2-en-1-yl)-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | L459-0497 |
| Compound Name: | N-(3-chloro-4-methoxyphenyl)-2-{[4-oxo-6-phenyl-3-(prop-2-en-1-yl)-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 498.02 |
| Molecular Formula: | C24 H20 Cl N3 O3 S2 |
| Smiles: | COc1ccc(cc1[Cl])NC(CSC1=Nc2cc(c3ccccc3)sc2C(N1CC=C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5719 |
| logD: | 5.5718 |
| logSw: | -5.8932 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.548 |
| InChI Key: | HHZDBTXWZMXAPC-UHFFFAOYSA-N |