N-tert-butyl-N-(2-{4-[(4-fluorophenoxy)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-fluorophenoxy)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-fluorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | V022-9765 |
| Compound Name: | N-tert-butyl-N-(2-{4-[(4-fluorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 524.61 |
| Molecular Formula: | C28 H29 F N2 O5 S |
| Smiles: | CC(C)(C)N(CC(N1CCc2c(ccs2)C1COc1ccc(cc1)F)=O)C(c1ccc2c(c1)OCO2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9241 |
| logD: | 4.9241 |
| logSw: | -4.6348 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.509 |
| InChI Key: | XZAAMSLHGFYDEH-QFIPXVFZSA-N |