N-tert-butyl-N-(2-{4-[(4-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-tert-butyl-N-(2-{4-[(4-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-2H-1,3-benzodioxole-5-carboxamide
N-tert-butyl-N-(2-{4-[(4-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | V020-9282 |
| Compound Name: | N-tert-butyl-N-(2-{4-[(4-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 520.65 |
| Molecular Formula: | C29 H32 N2 O5 S |
| Smiles: | Cc1ccc(cc1)OCC1c2ccsc2CCN1C(CN(C(c1ccc2c(c1)OCO2)=O)C(C)(C)C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3184 |
| logD: | 5.3184 |
| logSw: | -5.3232 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.509 |
| InChI Key: | HFNHPSWDAXCEKE-QHCPKHFHSA-N |