2-{[6-methyl-4-oxo-3-(2-phenylethyl)-3,4,6,7-tetrahydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide
Chemical Structure Depiction of
2-{[6-methyl-4-oxo-3-(2-phenylethyl)-3,4,6,7-tetrahydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide
2-{[6-methyl-4-oxo-3-(2-phenylethyl)-3,4,6,7-tetrahydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide
Compound characteristics
| Compound ID: | C280-0999 |
| Compound Name: | 2-{[6-methyl-4-oxo-3-(2-phenylethyl)-3,4,6,7-tetrahydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide |
| Molecular Weight: | 459.61 |
| Molecular Formula: | C20 H21 N5 O2 S3 |
| Smiles: | CC1CC2=C(C(N(CCc3ccccc3)C(=N2)SCC(Nc2nnc(C)s2)=O)=O)S1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0677 |
| logD: | 3.0372 |
| logSw: | -3.3601 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.587 |
| InChI Key: | ZXSDKRCDHQMYOF-GFCCVEGCSA-N |