ethyl 4-[(4-{[(2,1,3-benzothiadiazole-4-sulfonyl)amino]methyl}cyclohexane-1-carbonyl)amino]piperidine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-[(4-{[(2,1,3-benzothiadiazole-4-sulfonyl)amino]methyl}cyclohexane-1-carbonyl)amino]piperidine-1-carboxylate
ethyl 4-[(4-{[(2,1,3-benzothiadiazole-4-sulfonyl)amino]methyl}cyclohexane-1-carbonyl)amino]piperidine-1-carboxylate
Compound characteristics
| Compound ID: | C548-3574 |
| Compound Name: | ethyl 4-[(4-{[(2,1,3-benzothiadiazole-4-sulfonyl)amino]methyl}cyclohexane-1-carbonyl)amino]piperidine-1-carboxylate |
| Molecular Weight: | 509.65 |
| Molecular Formula: | C22 H31 N5 O5 S2 |
| Smiles: | CCOC(N1CCC(CC1)NC(C1CCC(CC1)CNS(c1cccc2c1nsn2)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0671 |
| logD: | 3.0655 |
| logSw: | -3.32 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 110.06 |
| InChI Key: | LTRFQKVEOWYOGF-UHFFFAOYSA-N |