benzyl 3-amino-4-(5-methylfuran-2-yl)-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxylate
Chemical Structure Depiction of
benzyl 3-amino-4-(5-methylfuran-2-yl)-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxylate
benzyl 3-amino-4-(5-methylfuran-2-yl)-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxylate
Compound characteristics
Compound ID: | K642-0073 |
Compound Name: | benzyl 3-amino-4-(5-methylfuran-2-yl)-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxylate |
Molecular Weight: | 418.51 |
Molecular Formula: | C24 H22 N2 O3 S |
Smiles: | Cc1ccc(c2c3CCCCc3nc3c2c(c(C(=O)OCc2ccccc2)s3)N)o1 |
Stereo: | ACHIRAL |
logP: | 5.8948 |
logD: | 5.8327 |
logSw: | -5.8503 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 59.445 |
InChI Key: | XGEOVFSADFHPEW-UHFFFAOYSA-N |