5-[{[5-(ethoxycarbonyl)-2,4-dimethyl-1H-pyrrol-3-yl]methyl}(4-fluorophenyl)amino]-5-oxopentanoic acid
Chemical Structure Depiction of
5-[{[5-(ethoxycarbonyl)-2,4-dimethyl-1H-pyrrol-3-yl]methyl}(4-fluorophenyl)amino]-5-oxopentanoic acid
5-[{[5-(ethoxycarbonyl)-2,4-dimethyl-1H-pyrrol-3-yl]methyl}(4-fluorophenyl)amino]-5-oxopentanoic acid
Compound characteristics
| Compound ID: | 8013-1579 |
| Compound Name: | 5-[{[5-(ethoxycarbonyl)-2,4-dimethyl-1H-pyrrol-3-yl]methyl}(4-fluorophenyl)amino]-5-oxopentanoic acid |
| Molecular Weight: | 404.44 |
| Molecular Formula: | C21 H25 F N2 O5 |
| Smiles: | CCOC(c1c(C)c(CN(C(CCCC(O)=O)=O)c2ccc(cc2)F)c(C)[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.927 |
| logD: | 0.3298 |
| logSw: | -3.2849 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.453 |
| InChI Key: | COPMSAIAOOVTDU-UHFFFAOYSA-N |