methyl 6-{[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-4-(2,4-dimethylphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
methyl 6-{[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-4-(2,4-dimethylphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
methyl 6-{[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-4-(2,4-dimethylphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | 8020-4623 |
| Compound Name: | methyl 6-{[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-4-(2,4-dimethylphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 405.5 |
| Molecular Formula: | C17 H19 N5 O3 S2 |
| Smiles: | Cc1ccc(C2C(=C(CSc3nnc(N)s3)NC(N2)=O)C(=O)OC)c(C)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5072 |
| logD: | 2.2987 |
| logSw: | -2.8319 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 100.864 |
| InChI Key: | BMQIRFDLZWWHGU-CYBMUJFWSA-N |