N-(3-acetamidophenyl)-3-chloro-6-nitro-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
N-(3-acetamidophenyl)-3-chloro-6-nitro-1-benzothiophene-2-carboxamide
N-(3-acetamidophenyl)-3-chloro-6-nitro-1-benzothiophene-2-carboxamide
Compound characteristics
| Compound ID: | Y205-4910 |
| Compound Name: | N-(3-acetamidophenyl)-3-chloro-6-nitro-1-benzothiophene-2-carboxamide |
| Molecular Weight: | 389.81 |
| Molecular Formula: | C17 H12 Cl N3 O4 S |
| Smiles: | CC(Nc1cccc(c1)NC(c1c(c2ccc(cc2s1)[N+]([O-])=O)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9205 |
| logD: | 3.9205 |
| logSw: | -4.5168 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.72 |
| InChI Key: | ZKALKDWDDZJJMF-UHFFFAOYSA-N |