N-(5-chloro-2,4-dimethoxyphenyl)-N'-[2-(methanesulfonyl)-1,3-benzothiazol-6-yl]urea
Chemical Structure Depiction of
N-(5-chloro-2,4-dimethoxyphenyl)-N'-[2-(methanesulfonyl)-1,3-benzothiazol-6-yl]urea
N-(5-chloro-2,4-dimethoxyphenyl)-N'-[2-(methanesulfonyl)-1,3-benzothiazol-6-yl]urea
Compound characteristics
| Compound ID: | M072-0188 |
| Compound Name: | N-(5-chloro-2,4-dimethoxyphenyl)-N'-[2-(methanesulfonyl)-1,3-benzothiazol-6-yl]urea |
| Molecular Weight: | 441.91 |
| Molecular Formula: | C17 H16 Cl N3 O5 S2 |
| Smiles: | COc1cc(c(cc1NC(Nc1ccc2c(c1)sc(n2)S(C)(=O)=O)=O)[Cl])OC |
| Stereo: | ACHIRAL |
| logP: | 3.5981 |
| logD: | 3.5969 |
| logSw: | -3.9555 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.349 |
| InChI Key: | HMFGVZVIUNAADX-UHFFFAOYSA-N |