ethyl 1-benzyl-4-(4-methoxyphenyl)-3-(2,3,4-trifluorobenzamido)-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 1-benzyl-4-(4-methoxyphenyl)-3-(2,3,4-trifluorobenzamido)-1H-pyrrole-2-carboxylate
ethyl 1-benzyl-4-(4-methoxyphenyl)-3-(2,3,4-trifluorobenzamido)-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V016-7231 |
| Compound Name: | ethyl 1-benzyl-4-(4-methoxyphenyl)-3-(2,3,4-trifluorobenzamido)-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 508.5 |
| Molecular Formula: | C28 H23 F3 N2 O4 |
| Smiles: | CCOC(c1c(c(cn1Cc1ccccc1)c1ccc(cc1)OC)NC(c1ccc(c(c1F)F)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6009 |
| logD: | 2.5738 |
| logSw: | -5.3328 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.218 |
| InChI Key: | DJNKXQUCUFAEKB-UHFFFAOYSA-N |