N-{5-[benzyl(methyl)amino]-1,3,4-thiadiazol-2-yl}-N'-(4-bromo-3-methylphenyl)urea
Chemical Structure Depiction of
N-{5-[benzyl(methyl)amino]-1,3,4-thiadiazol-2-yl}-N'-(4-bromo-3-methylphenyl)urea
N-{5-[benzyl(methyl)amino]-1,3,4-thiadiazol-2-yl}-N'-(4-bromo-3-methylphenyl)urea
Compound characteristics
| Compound ID: | E002-1509 |
| Compound Name: | N-{5-[benzyl(methyl)amino]-1,3,4-thiadiazol-2-yl}-N'-(4-bromo-3-methylphenyl)urea |
| Molecular Weight: | 432.34 |
| Molecular Formula: | C18 H18 Br N5 O S |
| Smiles: | Cc1cc(ccc1[Br])NC(Nc1nnc(N(C)Cc2ccccc2)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6243 |
| logD: | 5.6243 |
| logSw: | -5.3211 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.856 |
| InChI Key: | QVUFGOXKGNPBSC-UHFFFAOYSA-N |