N-{4-[chloro(difluoro)methoxy]phenyl}-1-nitro-9,10-dioxo-9,10-dihydroanthracene-2-carboxamide
Chemical Structure Depiction of
N-{4-[chloro(difluoro)methoxy]phenyl}-1-nitro-9,10-dioxo-9,10-dihydroanthracene-2-carboxamide
N-{4-[chloro(difluoro)methoxy]phenyl}-1-nitro-9,10-dioxo-9,10-dihydroanthracene-2-carboxamide
Compound characteristics
| Compound ID: | 8013-1671 |
| Compound Name: | N-{4-[chloro(difluoro)methoxy]phenyl}-1-nitro-9,10-dioxo-9,10-dihydroanthracene-2-carboxamide |
| Molecular Weight: | 472.79 |
| Molecular Formula: | C22 H11 Cl F2 N2 O6 |
| Smiles: | c1ccc2C(c3c(ccc(C(Nc4ccc(cc4)OC(F)(F)[Cl])=O)c3[N+]([O-])=O)C(c2c1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6987 |
| logD: | 5.5098 |
| logSw: | -6.201 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.549 |
| InChI Key: | SANMWHGOQRSVRK-UHFFFAOYSA-N |