methyl 1-{3-[1-(2-fluoro-4-methylphenyl)-1,4-dihydro[1]benzopyrano[4,3-b]pyrrol-2-yl]propanoyl}piperidine-4-carboxylate
Chemical Structure Depiction of
methyl 1-{3-[1-(2-fluoro-4-methylphenyl)-1,4-dihydro[1]benzopyrano[4,3-b]pyrrol-2-yl]propanoyl}piperidine-4-carboxylate
methyl 1-{3-[1-(2-fluoro-4-methylphenyl)-1,4-dihydro[1]benzopyrano[4,3-b]pyrrol-2-yl]propanoyl}piperidine-4-carboxylate
Compound characteristics
| Compound ID: | V010-7422 |
| Compound Name: | methyl 1-{3-[1-(2-fluoro-4-methylphenyl)-1,4-dihydro[1]benzopyrano[4,3-b]pyrrol-2-yl]propanoyl}piperidine-4-carboxylate |
| Molecular Weight: | 476.55 |
| Molecular Formula: | C28 H29 F N2 O4 |
| Smiles: | Cc1ccc(c(c1)F)n1c(CCC(N2CCC(CC2)C(=O)OC)=O)cc2COc3ccccc3c12 |
| Stereo: | ACHIRAL |
| logP: | 3.982 |
| logD: | 3.982 |
| logSw: | -4.1264 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.147 |
| InChI Key: | MRXDMMXPQHZDJF-UHFFFAOYSA-N |