ethyl (5-{2-[(4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]butanamido}-1,3,4-thiadiazol-2-yl)acetate
Chemical Structure Depiction of
ethyl (5-{2-[(4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]butanamido}-1,3,4-thiadiazol-2-yl)acetate
ethyl (5-{2-[(4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]butanamido}-1,3,4-thiadiazol-2-yl)acetate
Compound characteristics
| Compound ID: | 8014-1949 |
| Compound Name: | ethyl (5-{2-[(4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]butanamido}-1,3,4-thiadiazol-2-yl)acetate |
| Molecular Weight: | 397.47 |
| Molecular Formula: | C15 H19 N5 O4 S2 |
| Smiles: | CCC(C(Nc1nnc(CC(=O)OCC)s1)=O)SC1NC(C=C(C)N=1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7899 |
| logD: | 1.3875 |
| logSw: | -2.4876 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 101.862 |
| InChI Key: | APXRBSSNMRSDAP-VIFPVBQESA-N |