N-(3,5-dimethoxyphenyl)-N'-[2-(ethanesulfonyl)-1,3-benzothiazol-6-yl]urea
Chemical Structure Depiction of
N-(3,5-dimethoxyphenyl)-N'-[2-(ethanesulfonyl)-1,3-benzothiazol-6-yl]urea
N-(3,5-dimethoxyphenyl)-N'-[2-(ethanesulfonyl)-1,3-benzothiazol-6-yl]urea
Compound characteristics
| Compound ID: | M072-0090 |
| Compound Name: | N-(3,5-dimethoxyphenyl)-N'-[2-(ethanesulfonyl)-1,3-benzothiazol-6-yl]urea |
| Molecular Weight: | 421.49 |
| Molecular Formula: | C18 H19 N3 O5 S2 |
| Smiles: | CCS(c1nc2ccc(cc2s1)NC(Nc1cc(cc(c1)OC)OC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0881 |
| logD: | 4.088 |
| logSw: | -4.2655 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.16 |
| InChI Key: | NBKCZVLDQYTOAE-UHFFFAOYSA-N |