N-(2-methylphenyl)-N'-(4-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-6-oxo-1,6-dihydropyrimidin-2-yl)guanidine
Chemical Structure Depiction of
N-(2-methylphenyl)-N'-(4-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-6-oxo-1,6-dihydropyrimidin-2-yl)guanidine
N-(2-methylphenyl)-N'-(4-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-6-oxo-1,6-dihydropyrimidin-2-yl)guanidine
Compound characteristics
| Compound ID: | Y021-1719 |
| Compound Name: | N-(2-methylphenyl)-N'-(4-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-6-oxo-1,6-dihydropyrimidin-2-yl)guanidine |
| Molecular Weight: | 387.48 |
| Molecular Formula: | C16 H17 N7 O S2 |
| Smiles: | Cc1ccccc1NC(=N)NC1NC(C=C(CSc2nnc(C)s2)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9239 |
| logD: | 1.5655 |
| logSw: | -2.3156 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 94.36 |
| InChI Key: | MTQBQWGDCJNHSO-UHFFFAOYSA-N |