N-(5-chloro-2-methylphenyl)-N'-[2-(propane-2-sulfonyl)-1,3-benzothiazol-6-yl]urea
Chemical Structure Depiction of
N-(5-chloro-2-methylphenyl)-N'-[2-(propane-2-sulfonyl)-1,3-benzothiazol-6-yl]urea
N-(5-chloro-2-methylphenyl)-N'-[2-(propane-2-sulfonyl)-1,3-benzothiazol-6-yl]urea
Compound characteristics
| Compound ID: | M072-0456 |
| Compound Name: | N-(5-chloro-2-methylphenyl)-N'-[2-(propane-2-sulfonyl)-1,3-benzothiazol-6-yl]urea |
| Molecular Weight: | 423.94 |
| Molecular Formula: | C18 H18 Cl N3 O3 S2 |
| Smiles: | CC(C)S(c1nc2ccc(cc2s1)NC(Nc1cc(ccc1C)[Cl])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8584 |
| logD: | 4.8581 |
| logSw: | -4.8742 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.111 |
| InChI Key: | DTHKCGUAJFKLSP-UHFFFAOYSA-N |