3-methyl-N-(2-{4-[(4-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-[(oxolan-2-yl)methyl]butanamide
Chemical Structure Depiction of
3-methyl-N-(2-{4-[(4-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-[(oxolan-2-yl)methyl]butanamide
3-methyl-N-(2-{4-[(4-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-[(oxolan-2-yl)methyl]butanamide
Compound characteristics
| Compound ID: | V023-6485 |
| Compound Name: | 3-methyl-N-(2-{4-[(4-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-[(oxolan-2-yl)methyl]butanamide |
| Molecular Weight: | 484.66 |
| Molecular Formula: | C27 H36 N2 O4 S |
| Smiles: | CC(C)CC(N(CC1CCCO1)CC(N1CCc2c(ccs2)C1COc1ccc(C)cc1)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.4697 |
| logD: | 4.4697 |
| logSw: | -4.1246 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.413 |
| InChI Key: | HYYQZLJSQCQNTA-UHFFFAOYSA-N |