methyl 1-ethyl-3,5-dimethyl-4-{[2-(propan-2-yl)phenoxy]acetyl}-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 1-ethyl-3,5-dimethyl-4-{[2-(propan-2-yl)phenoxy]acetyl}-1H-pyrrole-2-carboxylate
methyl 1-ethyl-3,5-dimethyl-4-{[2-(propan-2-yl)phenoxy]acetyl}-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V001-8122 |
| Compound Name: | methyl 1-ethyl-3,5-dimethyl-4-{[2-(propan-2-yl)phenoxy]acetyl}-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 357.45 |
| Molecular Formula: | C21 H27 N O4 |
| Smiles: | CCn1c(C)c(C(COc2ccccc2C(C)C)=O)c(C)c1C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 4.5985 |
| logD: | 4.5985 |
| logSw: | -4.6223 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.697 |
| InChI Key: | NEIIBNIALHUHSN-UHFFFAOYSA-N |