N-{5-[benzyl(methyl)amino]-1,3,4-thiadiazol-2-yl}-N'-(3-chloro-2-methylphenyl)urea
Chemical Structure Depiction of
N-{5-[benzyl(methyl)amino]-1,3,4-thiadiazol-2-yl}-N'-(3-chloro-2-methylphenyl)urea
N-{5-[benzyl(methyl)amino]-1,3,4-thiadiazol-2-yl}-N'-(3-chloro-2-methylphenyl)urea
Compound characteristics
| Compound ID: | E002-1511 |
| Compound Name: | N-{5-[benzyl(methyl)amino]-1,3,4-thiadiazol-2-yl}-N'-(3-chloro-2-methylphenyl)urea |
| Molecular Weight: | 387.89 |
| Molecular Formula: | C18 H18 Cl N5 O S |
| Smiles: | Cc1c(cccc1[Cl])NC(Nc1nnc(N(C)Cc2ccccc2)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.258 |
| logD: | 5.2574 |
| logSw: | -5.6576 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.158 |
| InChI Key: | KIZWZWSOCKJGFZ-UHFFFAOYSA-N |