ethyl 4-({N-[(4-chlorophenyl)methyl]-4-fluorobenzamido}methyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 4-({N-[(4-chlorophenyl)methyl]-4-fluorobenzamido}methyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate
ethyl 4-({N-[(4-chlorophenyl)methyl]-4-fluorobenzamido}methyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | G798-0763 |
| Compound Name: | ethyl 4-({N-[(4-chlorophenyl)methyl]-4-fluorobenzamido}methyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 442.92 |
| Molecular Formula: | C24 H24 Cl F N2 O3 |
| Smiles: | CCOC(c1c(C)c(CN(Cc2ccc(cc2)[Cl])C(c2ccc(cc2)F)=O)c(C)[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8578 |
| logD: | 4.8578 |
| logSw: | -4.8881 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.913 |
| InChI Key: | PTWONALLFHDLMN-UHFFFAOYSA-N |