N-(3,5-dimethylphenyl)-N'-[2-(2-methylpropane-1-sulfonyl)-1,3-benzothiazol-6-yl]urea
Chemical Structure Depiction of
N-(3,5-dimethylphenyl)-N'-[2-(2-methylpropane-1-sulfonyl)-1,3-benzothiazol-6-yl]urea
N-(3,5-dimethylphenyl)-N'-[2-(2-methylpropane-1-sulfonyl)-1,3-benzothiazol-6-yl]urea
Compound characteristics
| Compound ID: | M072-0551 |
| Compound Name: | N-(3,5-dimethylphenyl)-N'-[2-(2-methylpropane-1-sulfonyl)-1,3-benzothiazol-6-yl]urea |
| Molecular Weight: | 417.55 |
| Molecular Formula: | C20 H23 N3 O3 S2 |
| Smiles: | CC(C)CS(c1nc2ccc(cc2s1)NC(Nc1cc(C)cc(C)c1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6267 |
| logD: | 5.6267 |
| logSw: | -5.3724 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.073 |
| InChI Key: | BKPLWPRQBKBRNL-UHFFFAOYSA-N |