N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-phenyl-8H-[1,3]dioxolo[4,5-g]thieno[3,2-c]quinoline-2-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-phenyl-8H-[1,3]dioxolo[4,5-g]thieno[3,2-c]quinoline-2-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-phenyl-8H-[1,3]dioxolo[4,5-g]thieno[3,2-c]quinoline-2-carboxamide
Compound characteristics
| Compound ID: | F477-0260 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-phenyl-8H-[1,3]dioxolo[4,5-g]thieno[3,2-c]quinoline-2-carboxamide |
| Molecular Weight: | 482.51 |
| Molecular Formula: | C27 H18 N2 O5 S |
| Smiles: | C(c1ccc2c(c1)OCO2)NC(c1c(c2ccccc2)c2cnc3cc4c(cc3c2s1)OCO4)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8464 |
| logD: | 5.8451 |
| logSw: | -5.8824 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.21 |
| InChI Key: | IUKGOWROZCZNCX-UHFFFAOYSA-N |