N-(4-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-6-oxo-1,6-dihydropyrimidin-2-yl)-N'-[2-(phenylsulfanyl)phenyl]guanidine
Chemical Structure Depiction of
N-(4-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-6-oxo-1,6-dihydropyrimidin-2-yl)-N'-[2-(phenylsulfanyl)phenyl]guanidine
N-(4-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-6-oxo-1,6-dihydropyrimidin-2-yl)-N'-[2-(phenylsulfanyl)phenyl]guanidine
Compound characteristics
| Compound ID: | Y021-2054 |
| Compound Name: | N-(4-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-6-oxo-1,6-dihydropyrimidin-2-yl)-N'-[2-(phenylsulfanyl)phenyl]guanidine |
| Molecular Weight: | 481.62 |
| Molecular Formula: | C21 H19 N7 O S3 |
| Smiles: | Cc1nnc(SCC2=CC(NC(NC(=N)Nc3ccccc3Sc3ccccc3)=N2)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.6674 |
| logD: | 3.4283 |
| logSw: | -3.8605 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 94.088 |
| InChI Key: | LPCJDZSCOSAQOO-UHFFFAOYSA-N |