N-[(4-methoxyphenyl)methyl]-N'-[2-(propane-2-sulfonyl)-1,3-benzothiazol-6-yl]urea
Chemical Structure Depiction of
N-[(4-methoxyphenyl)methyl]-N'-[2-(propane-2-sulfonyl)-1,3-benzothiazol-6-yl]urea
N-[(4-methoxyphenyl)methyl]-N'-[2-(propane-2-sulfonyl)-1,3-benzothiazol-6-yl]urea
Compound characteristics
| Compound ID: | M072-0513 |
| Compound Name: | N-[(4-methoxyphenyl)methyl]-N'-[2-(propane-2-sulfonyl)-1,3-benzothiazol-6-yl]urea |
| Molecular Weight: | 419.52 |
| Molecular Formula: | C19 H21 N3 O4 S2 |
| Smiles: | CC(C)S(c1nc2ccc(cc2s1)NC(NCc1ccc(cc1)OC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5992 |
| logD: | 3.5992 |
| logSw: | -3.8896 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.675 |
| InChI Key: | GRGBQOMFBKVREX-UHFFFAOYSA-N |