methyl 3-{[8-fluoro-2-(pyrrolidin-1-yl)quinolin-6-yl]carbamamido}benzoate
Chemical Structure Depiction of
methyl 3-{[8-fluoro-2-(pyrrolidin-1-yl)quinolin-6-yl]carbamamido}benzoate
methyl 3-{[8-fluoro-2-(pyrrolidin-1-yl)quinolin-6-yl]carbamamido}benzoate
Compound characteristics
| Compound ID: | L438-0073 |
| Compound Name: | methyl 3-{[8-fluoro-2-(pyrrolidin-1-yl)quinolin-6-yl]carbamamido}benzoate |
| Molecular Weight: | 408.43 |
| Molecular Formula: | C22 H21 F N4 O3 |
| Smiles: | COC(c1cccc(c1)NC(Nc1cc(c2c(ccc(n2)N2CCCC2)c1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5625 |
| logD: | 5.5624 |
| logSw: | -5.773 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.098 |
| InChI Key: | XVEOZIHUOODRPS-UHFFFAOYSA-N |