3-chloro-N-(3,4-difluorophenyl)-6-nitro-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
3-chloro-N-(3,4-difluorophenyl)-6-nitro-1-benzothiophene-2-carboxamide
3-chloro-N-(3,4-difluorophenyl)-6-nitro-1-benzothiophene-2-carboxamide
Compound characteristics
| Compound ID: | Y500-0900 |
| Compound Name: | 3-chloro-N-(3,4-difluorophenyl)-6-nitro-1-benzothiophene-2-carboxamide |
| Molecular Weight: | 368.74 |
| Molecular Formula: | C15 H7 Cl F2 N2 O3 S |
| Smiles: | c1cc(c(cc1NC(c1c(c2ccc(cc2s1)[N+]([O-])=O)[Cl])=O)F)F |
| Stereo: | ACHIRAL |
| logP: | 5.0724 |
| logD: | 4.7176 |
| logSw: | -5.4178 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.458 |
| InChI Key: | ZXSHKEKSKUOJDK-UHFFFAOYSA-N |