3-amino-6-[chloro(difluoro)methyl]-4-methyl-N-(4-nitrophenyl)thieno[2,3-b]pyridine-2-carboxamide
Chemical Structure Depiction of
3-amino-6-[chloro(difluoro)methyl]-4-methyl-N-(4-nitrophenyl)thieno[2,3-b]pyridine-2-carboxamide
3-amino-6-[chloro(difluoro)methyl]-4-methyl-N-(4-nitrophenyl)thieno[2,3-b]pyridine-2-carboxamide
Compound characteristics
| Compound ID: | Y502-0232 |
| Compound Name: | 3-amino-6-[chloro(difluoro)methyl]-4-methyl-N-(4-nitrophenyl)thieno[2,3-b]pyridine-2-carboxamide |
| Molecular Weight: | 412.8 |
| Molecular Formula: | C16 H11 Cl F2 N4 O3 S |
| Smiles: | Cc1cc(C(F)(F)[Cl])nc2c1c(c(C(Nc1ccc(cc1)[N+]([O-])=O)=O)s2)N |
| Stereo: | ACHIRAL |
| logP: | 4.6935 |
| logD: | 4.6926 |
| logSw: | -4.9859 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 85.818 |
| InChI Key: | VTAYWNDXQJUOBW-UHFFFAOYSA-N |