N-[(4-methoxyphenyl)methyl]-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-[(4-methoxyphenyl)methyl]-2-{[4-oxo-6-phenyl-3-(prop-2-en-1-yl)-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
N-[(4-methoxyphenyl)methyl]-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: | L459-0399 |
| Compound Name: | N-[(4-methoxyphenyl)methyl]-2-{[4-oxo-6-phenyl-3-(prop-2-en-1-yl)-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 477.6 |
| Molecular Formula: | C25 H23 N3 O3 S2 |
| Smiles: | COc1ccc(CNC(CSC2=Nc3cc(c4ccccc4)sc3C(N2CC=C)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.725 |
| logD: | 4.725 |
| logSw: | -4.458 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.783 |
| InChI Key: | SUQMIGGXAPCWAH-UHFFFAOYSA-N |