ethyl 4-[(4-{[(5-bromothiophene-2-sulfonyl)amino]methyl}cyclohexane-1-carbonyl)amino]benzoate
Chemical Structure Depiction of
ethyl 4-[(4-{[(5-bromothiophene-2-sulfonyl)amino]methyl}cyclohexane-1-carbonyl)amino]benzoate
ethyl 4-[(4-{[(5-bromothiophene-2-sulfonyl)amino]methyl}cyclohexane-1-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | C274-3581 |
| Compound Name: | ethyl 4-[(4-{[(5-bromothiophene-2-sulfonyl)amino]methyl}cyclohexane-1-carbonyl)amino]benzoate |
| Molecular Weight: | 529.47 |
| Molecular Formula: | C21 H25 Br N2 O5 S2 |
| Smiles: | CCOC(c1ccc(cc1)NC(C1CCC(CC1)CNS(c1ccc(s1)[Br])(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1426 |
| logD: | 5.1421 |
| logSw: | -5.0902 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.052 |
| InChI Key: | SKKQUTOTGKOPJT-UHFFFAOYSA-N |