N-[2-(3,4-dimethoxyphenyl)ethyl]-2-{[4-oxo-6-phenyl-3-(prop-2-en-1-yl)-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-{[4-oxo-6-phenyl-3-(prop-2-en-1-yl)-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-{[4-oxo-6-phenyl-3-(prop-2-en-1-yl)-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | 4112-4236 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-2-{[4-oxo-6-phenyl-3-(prop-2-en-1-yl)-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 521.66 |
| Molecular Formula: | C27 H27 N3 O4 S2 |
| Smiles: | COc1ccc(CCNC(CSC2=Nc3c(cc(c4ccccc4)s3)C(N2CC=C)=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 4.0766 |
| logD: | 4.0766 |
| logSw: | -4.2148 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.226 |
| InChI Key: | HTCKHCGONVZGRA-UHFFFAOYSA-N |