N-tert-butyl-N-(2-{4-[(2,4-dimethylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-4-methylbenzamide
Chemical Structure Depiction of
N-tert-butyl-N-(2-{4-[(2,4-dimethylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-4-methylbenzamide
N-tert-butyl-N-(2-{4-[(2,4-dimethylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-4-methylbenzamide
Compound characteristics
| Compound ID: | V022-9672 |
| Compound Name: | N-tert-butyl-N-(2-{4-[(2,4-dimethylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-4-methylbenzamide |
| Molecular Weight: | 504.69 |
| Molecular Formula: | C30 H36 N2 O3 S |
| Smiles: | Cc1ccc(cc1)C(N(CC(N1CCc2c(ccs2)C1COc1ccc(C)cc1C)=O)C(C)(C)C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.729 |
| logD: | 6.729 |
| logSw: | -5.5898 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.48 |
| InChI Key: | DQCMMXFROLMXIN-VWLOTQADSA-N |