3-chloro-N-(2-methyl-5-nitrophenyl)-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
3-chloro-N-(2-methyl-5-nitrophenyl)-1-benzothiophene-2-carboxamide
3-chloro-N-(2-methyl-5-nitrophenyl)-1-benzothiophene-2-carboxamide
Compound characteristics
| Compound ID: | 2043-2705 |
| Compound Name: | 3-chloro-N-(2-methyl-5-nitrophenyl)-1-benzothiophene-2-carboxamide |
| Molecular Weight: | 346.79 |
| Molecular Formula: | C16 H11 Cl N2 O3 S |
| Smiles: | Cc1ccc(cc1NC(c1c(c2ccccc2s1)[Cl])=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.6657 |
| logD: | 4.5891 |
| logSw: | -5.0399 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.76 |
| InChI Key: | KSWAKUNCGSYFAM-UHFFFAOYSA-N |