N-(2-methyl-5-nitrophenyl)-1-benzothiophene-3-carboxamide
Chemical Structure Depiction of
N-(2-methyl-5-nitrophenyl)-1-benzothiophene-3-carboxamide
N-(2-methyl-5-nitrophenyl)-1-benzothiophene-3-carboxamide
Compound characteristics
| Compound ID: | Y500-9256 |
| Compound Name: | N-(2-methyl-5-nitrophenyl)-1-benzothiophene-3-carboxamide |
| Molecular Weight: | 312.34 |
| Molecular Formula: | C16 H12 N2 O3 S |
| Smiles: | Cc1ccc(cc1NC(c1csc2ccccc12)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.9967 |
| logD: | 3.9966 |
| logSw: | -4.2013 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.76 |
| InChI Key: | PGPGJYUONFJQNS-UHFFFAOYSA-N |