ethyl 3,5-dimethyl-4-octanoyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 3,5-dimethyl-4-octanoyl-1H-pyrrole-2-carboxylate
ethyl 3,5-dimethyl-4-octanoyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | 8006-8172 |
| Compound Name: | ethyl 3,5-dimethyl-4-octanoyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 293.4 |
| Molecular Formula: | C17 H27 N O3 |
| Smiles: | CCCCCCCC(c1c(C)c(C(=O)OCC)[nH]c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7412 |
| logD: | 4.7412 |
| logSw: | -4.4612 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.221 |
| InChI Key: | WJSMUMZJDISDJP-UHFFFAOYSA-N |