ethyl 4-({[(3-bromophenyl)methyl](3-{[2-chloro-5-(trifluoromethyl)phenyl]carbamoyl}-4-fluorobenzene-1-sulfonyl)amino}methyl)cyclohexane-1-carboxylate
Chemical Structure Depiction of
ethyl 4-({[(3-bromophenyl)methyl](3-{[2-chloro-5-(trifluoromethyl)phenyl]carbamoyl}-4-fluorobenzene-1-sulfonyl)amino}methyl)cyclohexane-1-carboxylate
ethyl 4-({[(3-bromophenyl)methyl](3-{[2-chloro-5-(trifluoromethyl)phenyl]carbamoyl}-4-fluorobenzene-1-sulfonyl)amino}methyl)cyclohexane-1-carboxylate
Compound characteristics
| Compound ID: | K784-4238 |
| Compound Name: | ethyl 4-({[(3-bromophenyl)methyl](3-{[2-chloro-5-(trifluoromethyl)phenyl]carbamoyl}-4-fluorobenzene-1-sulfonyl)amino}methyl)cyclohexane-1-carboxylate |
| Molecular Weight: | 734 |
| Molecular Formula: | C31 H30 Br Cl F4 N2 O5 S |
| Smiles: | CCOC(C1CCC(CC1)CN(Cc1cccc(c1)[Br])S(c1ccc(c(c1)C(Nc1cc(ccc1[Cl])C(F)(F)F)=O)F)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 8.6118 |
| logD: | 6.53 |
| logSw: | -6.4733 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.682 |
| InChI Key: | SRMFWOPIOCXHDI-UHFFFAOYSA-N |