N-(3-chloro-2-methylphenyl)-N'-[2-(propane-2-sulfonyl)-1,3-benzothiazol-6-yl]urea
Chemical Structure Depiction of
N-(3-chloro-2-methylphenyl)-N'-[2-(propane-2-sulfonyl)-1,3-benzothiazol-6-yl]urea
N-(3-chloro-2-methylphenyl)-N'-[2-(propane-2-sulfonyl)-1,3-benzothiazol-6-yl]urea
Compound characteristics
| Compound ID: | M072-0466 |
| Compound Name: | N-(3-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(Nc1cccc(c1C)[Cl])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2086 |
| logD: | 5.2083 |
| logSw: | -5.7087 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.111 |
| InChI Key: | ABFXHVIEWPNOLL-UHFFFAOYSA-N |