methyl 2-{2-[4-(quinoxalin-2-yl)phenoxy]propanamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-{2-[4-(quinoxalin-2-yl)phenoxy]propanamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
methyl 2-{2-[4-(quinoxalin-2-yl)phenoxy]propanamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | L466-0609 |
| Compound Name: | methyl 2-{2-[4-(quinoxalin-2-yl)phenoxy]propanamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 487.58 |
| Molecular Formula: | C27 H25 N3 O4 S |
| Smiles: | CC(C(Nc1c(C(=O)OC)c2CCCCc2s1)=O)Oc1ccc(cc1)c1cnc2ccccc2n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.8196 |
| logD: | 3.3868 |
| logSw: | -5.4653 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.191 |
| InChI Key: | JWAFNTLCXCXIHY-INIZCTEOSA-N |