ethyl 3-benzamido-1-benzyl-4-(4-methoxyphenyl)-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 3-benzamido-1-benzyl-4-(4-methoxyphenyl)-1H-pyrrole-2-carboxylate
ethyl 3-benzamido-1-benzyl-4-(4-methoxyphenyl)-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V012-0857 |
| Compound Name: | ethyl 3-benzamido-1-benzyl-4-(4-methoxyphenyl)-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 454.53 |
| Molecular Formula: | C28 H26 N2 O4 |
| Smiles: | CCOC(c1c(c(cn1Cc1ccccc1)c1ccc(cc1)OC)NC(c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8243 |
| logD: | 4.381 |
| logSw: | -4.3878 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.218 |
| InChI Key: | IQDDQAXRXOMPLI-UHFFFAOYSA-N |