N-[4-(1,3-benzothiazol-2-yl)-2-methylphenyl]-N'-(4-bromophenyl)urea
Chemical Structure Depiction of
N-[4-(1,3-benzothiazol-2-yl)-2-methylphenyl]-N'-(4-bromophenyl)urea
N-[4-(1,3-benzothiazol-2-yl)-2-methylphenyl]-N'-(4-bromophenyl)urea
Compound characteristics
| Compound ID: | L320-0424 |
| Compound Name: | N-[4-(1,3-benzothiazol-2-yl)-2-methylphenyl]-N'-(4-bromophenyl)urea |
| Molecular Weight: | 438.34 |
| Molecular Formula: | C21 H16 Br N3 O S |
| Smiles: | Cc1cc(ccc1NC(Nc1ccc(cc1)[Br])=O)c1nc2ccccc2s1 |
| Stereo: | ACHIRAL |
| logP: | 6.5087 |
| logD: | 6.5086 |
| logSw: | -5.6702 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 41.292 |
| InChI Key: | ZMEXYINUXMVQCZ-UHFFFAOYSA-N |