ethyl 1-benzyl-4-(butylcarbamoyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 1-benzyl-4-(butylcarbamoyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate
ethyl 1-benzyl-4-(butylcarbamoyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | C722-1004 |
| Compound Name: | ethyl 1-benzyl-4-(butylcarbamoyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 356.46 |
| Molecular Formula: | C21 H28 N2 O3 |
| Smiles: | CCCCNC(c1c(C)c(C(=O)OCC)n(Cc2ccccc2)c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0665 |
| logD: | 4.0665 |
| logSw: | -4.0395 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.245 |
| InChI Key: | ZKWPWFZGPSGIMT-UHFFFAOYSA-N |