(2Z)-N-(3a,7a-dihydro-2H-1,3-benzodioxol-5-yl)-2-[(4-fluorophenyl)imino]-5-(hydroxymethyl)-8-methyl-2H-pyrano[2,3-c]pyridine-3-carboxamide
Chemical Structure Depiction of
(2Z)-N-(3a,7a-dihydro-2H-1,3-benzodioxol-5-yl)-2-[(4-fluorophenyl)imino]-5-(hydroxymethyl)-8-methyl-2H-pyrano[2,3-c]pyridine-3-carboxamide
(2Z)-N-(3a,7a-dihydro-2H-1,3-benzodioxol-5-yl)-2-[(4-fluorophenyl)imino]-5-(hydroxymethyl)-8-methyl-2H-pyrano[2,3-c]pyridine-3-carboxamide
Compound characteristics
| Compound ID: | K227-0866 |
| Compound Name: | (2Z)-N-(3a,7a-dihydro-2H-1,3-benzodioxol-5-yl)-2-[(4-fluorophenyl)imino]-5-(hydroxymethyl)-8-methyl-2H-pyrano[2,3-c]pyridine-3-carboxamide |
| Molecular Weight: | 449.44 |
| Molecular Formula: | C24 H20 F N3 O5 |
| Smiles: | Cc1c2c(C=C(/C(=N/c3ccc(cc3)F)O2)C(NC2C=CC3C(C=2)OCO3)=O)c(CO)cn1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.8483 |
| logD: | 1.7802 |
| logSw: | -2.2657 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.046 |
| InChI Key: | RINCQWLNQLKGFZ-UHFFFAOYSA-N |