N-[3-(4-bromophenoxy)-5-nitrophenyl]-3-chloro-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
N-[3-(4-bromophenoxy)-5-nitrophenyl]-3-chloro-1-benzothiophene-2-carboxamide
N-[3-(4-bromophenoxy)-5-nitrophenyl]-3-chloro-1-benzothiophene-2-carboxamide
Compound characteristics
| Compound ID: | 8006-9262 |
| Compound Name: | N-[3-(4-bromophenoxy)-5-nitrophenyl]-3-chloro-1-benzothiophene-2-carboxamide |
| Molecular Weight: | 503.76 |
| Molecular Formula: | C21 H12 Br Cl N2 O4 S |
| Smiles: | c1ccc2c(c1)c(c(C(Nc1cc(cc(c1)Oc1ccc(cc1)[Br])[N+]([O-])=O)=O)s2)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 7.3703 |
| logD: | 7.3294 |
| logSw: | -6.762 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.206 |
| InChI Key: | YDKPUQUVDVHOLH-UHFFFAOYSA-N |