ethyl 4-{[(2H-1,3-benzodioxol-5-yl)oxy]acetyl}-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 4-{[(2H-1,3-benzodioxol-5-yl)oxy]acetyl}-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
ethyl 4-{[(2H-1,3-benzodioxol-5-yl)oxy]acetyl}-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V029-8320 |
| Compound Name: | ethyl 4-{[(2H-1,3-benzodioxol-5-yl)oxy]acetyl}-1,3,5-trimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 359.38 |
| Molecular Formula: | C19 H21 N O6 |
| Salt: | not_available |
| Smiles: | CCOC(c1c(C)c(C(COc2ccc3c(c2)OCO3)=O)c(C)n1C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7221 |
| logD: | 2.7221 |
| logSw: | -3.0227 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.39 |
| InChI Key: | NGHAAJCKTQTYSN-UHFFFAOYSA-N |