N-(3-methylphenyl)-N'-[2-(2-methylpropane-1-sulfonyl)-1,3-benzothiazol-6-yl]urea
Chemical Structure Depiction of
N-(3-methylphenyl)-N'-[2-(2-methylpropane-1-sulfonyl)-1,3-benzothiazol-6-yl]urea
N-(3-methylphenyl)-N'-[2-(2-methylpropane-1-sulfonyl)-1,3-benzothiazol-6-yl]urea
Compound characteristics
| Compound ID: | M072-0565 |
| Compound Name: | N-(3-methylphenyl)-N'-[2-(2-methylpropane-1-sulfonyl)-1,3-benzothiazol-6-yl]urea |
| Molecular Weight: | 403.52 |
| Molecular Formula: | C19 H21 N3 O3 S2 |
| Smiles: | CC(C)CS(c1nc2ccc(cc2s1)NC(Nc1cccc(C)c1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2936 |
| logD: | 5.2936 |
| logSw: | -5.2531 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.073 |
| InChI Key: | UUMWQLGZXUMIKR-UHFFFAOYSA-N |