ethyl 3,5-dimethyl-4-(3-phenylprop-2-enoyl)-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 3,5-dimethyl-4-(3-phenylprop-2-enoyl)-1H-pyrrole-2-carboxylate
ethyl 3,5-dimethyl-4-(3-phenylprop-2-enoyl)-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | K906-1315 |
| Compound Name: | ethyl 3,5-dimethyl-4-(3-phenylprop-2-enoyl)-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 297.35 |
| Molecular Formula: | C18 H19 N O3 |
| Smiles: | CCOC(c1c(C)c(C(/C=C/c2ccccc2)=O)c(C)[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9029 |
| logD: | 3.9029 |
| logSw: | -4.1701 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.949 |
| InChI Key: | QDYFTUFZXFSLLQ-UHFFFAOYSA-N |