8-methoxy-N-{2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethyl}-6-nitro-2-oxo-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
8-methoxy-N-{2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethyl}-6-nitro-2-oxo-2H-1-benzopyran-3-carboxamide
8-methoxy-N-{2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethyl}-6-nitro-2-oxo-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | 8013-4385 |
| Compound Name: | 8-methoxy-N-{2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethyl}-6-nitro-2-oxo-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 505.41 |
| Molecular Formula: | C23 H18 F3 N3 O7 |
| Smiles: | Cc1c(CCNC(C2=Cc3cc(cc(c3OC2=O)OC)[N+]([O-])=O)=O)c2cc(ccc2[nH]1)OC(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 4.1598 |
| logD: | 4.1598 |
| logSw: | -4.4904 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 101.974 |
| InChI Key: | YVDHIHXYAQWYTF-UHFFFAOYSA-N |