N-(4-chlorophenyl)-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-(4-chlorophenyl)-N'-(4-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-6-oxo-1,6-dihydropyrimidin-2-yl)guanidine
N-(4-chlorophenyl)-N'-(4-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-6-oxo-1,6-dihydropyrimidin-2-yl)guanidine
Compound characteristics
| Compound ID: | Y021-1713 |
| Compound Name: | N-(4-chlorophenyl)-N'-(4-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-6-oxo-1,6-dihydropyrimidin-2-yl)guanidine |
| Molecular Weight: | 407.9 |
| Molecular Formula: | C15 H14 Cl N7 O S2 |
| Smiles: | Cc1nnc(SCC2=CC(NC(NC(=N)Nc3ccc(cc3)[Cl])=N2)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 2.6772 |
| logD: | 2.3365 |
| logSw: | -3.5275 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 95.058 |
| InChI Key: | BCTTWEPDLLRHSJ-UHFFFAOYSA-N |