benzyl 5-formyl-2,4-dimethyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
benzyl 5-formyl-2,4-dimethyl-1H-pyrrole-3-carboxylate
benzyl 5-formyl-2,4-dimethyl-1H-pyrrole-3-carboxylate
Compound characteristics
Compound ID: | 8009-1569 |
Compound Name: | benzyl 5-formyl-2,4-dimethyl-1H-pyrrole-3-carboxylate |
Molecular Weight: | 257.29 |
Molecular Formula: | C15 H15 N O3 |
Smiles: | Cc1c(C(=O)OCc2ccccc2)c(C)[nH]c1C=O |
Stereo: | ACHIRAL |
logP: | 2.6184 |
logD: | 2.6184 |
logSw: | -2.7199 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 46.732 |
InChI Key: | QUZUDKKOORVFBU-UHFFFAOYSA-N |