4-{[(2,1,3-benzothiadiazole-4-sulfonyl)amino]methyl}-N-(3-ethylphenyl)cyclohexane-1-carboxamide
Chemical Structure Depiction of
4-{[(2,1,3-benzothiadiazole-4-sulfonyl)amino]methyl}-N-(3-ethylphenyl)cyclohexane-1-carboxamide
4-{[(2,1,3-benzothiadiazole-4-sulfonyl)amino]methyl}-N-(3-ethylphenyl)cyclohexane-1-carboxamide
Compound characteristics
Compound ID: | C548-3561 |
Compound Name: | 4-{[(2,1,3-benzothiadiazole-4-sulfonyl)amino]methyl}-N-(3-ethylphenyl)cyclohexane-1-carboxamide |
Molecular Weight: | 458.6 |
Molecular Formula: | C22 H26 N4 O3 S2 |
Smiles: | CCc1cccc(c1)NC(C1CCC(CC1)CNS(c1cccc2c1nsn2)(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.6646 |
logD: | 4.663 |
logSw: | -4.4542 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 86.233 |
InChI Key: | VVUJBHHWQVFHQT-UHFFFAOYSA-N |