methyl 2-{[8-fluoro-2-(piperidin-1-yl)quinolin-6-yl]carbamamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-{[8-fluoro-2-(piperidin-1-yl)quinolin-6-yl]carbamamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
methyl 2-{[8-fluoro-2-(piperidin-1-yl)quinolin-6-yl]carbamamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | L438-0188 |
| Compound Name: | methyl 2-{[8-fluoro-2-(piperidin-1-yl)quinolin-6-yl]carbamamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 482.58 |
| Molecular Formula: | C25 H27 F N4 O3 S |
| Smiles: | COC(c1c2CCCCc2sc1NC(Nc1cc(c2c(ccc(n2)N2CCCCC2)c1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.3726 |
| logD: | 4.006 |
| logSw: | -5.8743 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.447 |
| InChI Key: | QKBLYCLFHJFUJV-UHFFFAOYSA-N |