N-[2-(methanesulfonyl)-1,3-benzothiazol-6-yl]-N'-(4-methylphenyl)urea
Chemical Structure Depiction of
N-[2-(methanesulfonyl)-1,3-benzothiazol-6-yl]-N'-(4-methylphenyl)urea
N-[2-(methanesulfonyl)-1,3-benzothiazol-6-yl]-N'-(4-methylphenyl)urea
Compound characteristics
| Compound ID: | M072-0115 |
| Compound Name: | N-[2-(methanesulfonyl)-1,3-benzothiazol-6-yl]-N'-(4-methylphenyl)urea |
| Molecular Weight: | 361.44 |
| Molecular Formula: | C16 H15 N3 O3 S2 |
| Smiles: | Cc1ccc(cc1)NC(Nc1ccc2c(c1)sc(n2)S(C)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7218 |
| logD: | 3.7218 |
| logSw: | -3.8914 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.786 |
| InChI Key: | PFVWNZWAAPVRGO-UHFFFAOYSA-N |