methyl 2-methyl-5-oxo-4-({3-[(prop-2-en-1-yl)oxy]phenyl}methylidene)-4,5-dihydro-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
methyl 2-methyl-5-oxo-4-({3-[(prop-2-en-1-yl)oxy]phenyl}methylidene)-4,5-dihydro-1H-pyrrole-3-carboxylate
methyl 2-methyl-5-oxo-4-({3-[(prop-2-en-1-yl)oxy]phenyl}methylidene)-4,5-dihydro-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | 4191-0248 |
| Compound Name: | methyl 2-methyl-5-oxo-4-({3-[(prop-2-en-1-yl)oxy]phenyl}methylidene)-4,5-dihydro-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 299.32 |
| Molecular Formula: | C17 H17 N O4 |
| Smiles: | CC1=C(/C(=C/c2cccc(c2)OCC=C)C(N1)=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.5542 |
| logD: | 2.3393 |
| logSw: | -2.9054 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.453 |
| InChI Key: | LMWLOEIYCLOVML-UHFFFAOYSA-N |