N-(2,4-dimethoxyphenyl)-N'-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]urea
Chemical Structure Depiction of
N-(2,4-dimethoxyphenyl)-N'-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]urea
N-(2,4-dimethoxyphenyl)-N'-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]urea
Compound characteristics
Compound ID: | D408-0780 |
Compound Name: | N-(2,4-dimethoxyphenyl)-N'-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]urea |
Molecular Weight: | 407.47 |
Molecular Formula: | C17 H17 N3 O5 S2 |
Smiles: | COc1ccc(c(c1)OC)NC(Nc1nc2ccc(cc2s1)S(C)(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 2.8093 |
logD: | 2.8093 |
logSw: | -3.7067 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 86.528 |
InChI Key: | IMUQKQIUVREBBS-UHFFFAOYSA-N |