N-(2,5-difluorophenyl)-N'-[2-(propane-2-sulfonyl)-1,3-benzothiazol-6-yl]urea
Chemical Structure Depiction of
N-(2,5-difluorophenyl)-N'-[2-(propane-2-sulfonyl)-1,3-benzothiazol-6-yl]urea
N-(2,5-difluorophenyl)-N'-[2-(propane-2-sulfonyl)-1,3-benzothiazol-6-yl]urea
Compound characteristics
Compound ID: | M072-0481 |
Compound Name: | N-(2,5-difluorophenyl)-N'-[2-(propane-2-sulfonyl)-1,3-benzothiazol-6-yl]urea |
Molecular Weight: | 411.45 |
Molecular Formula: | C17 H15 F2 N3 O3 S2 |
Smiles: | CC(C)S(c1nc2ccc(cc2s1)NC(Nc1cc(ccc1F)F)=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 4.5685 |
logD: | 4.567 |
logSw: | -4.4151 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 71.111 |
InChI Key: | CHKSBVAXMZJQGR-UHFFFAOYSA-N |