3-chloro-6-nitro-N-(2-phenylethyl)-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
3-chloro-6-nitro-N-(2-phenylethyl)-1-benzothiophene-2-carboxamide
3-chloro-6-nitro-N-(2-phenylethyl)-1-benzothiophene-2-carboxamide
Compound characteristics
| Compound ID: | Y203-5525 |
| Compound Name: | 3-chloro-6-nitro-N-(2-phenylethyl)-1-benzothiophene-2-carboxamide |
| Molecular Weight: | 360.82 |
| Molecular Formula: | C17 H13 Cl N2 O3 S |
| Smiles: | C(CNC(c1c(c2ccc(cc2s1)[N+]([O-])=O)[Cl])=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.4466 |
| logD: | 4.4466 |
| logSw: | -4.8232 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.622 |
| InChI Key: | UQODICXVWJRPKS-UHFFFAOYSA-N |