3-chloro-N-(3-nitro-5-phenoxyphenyl)-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
3-chloro-N-(3-nitro-5-phenoxyphenyl)-1-benzothiophene-2-carboxamide
3-chloro-N-(3-nitro-5-phenoxyphenyl)-1-benzothiophene-2-carboxamide
Compound characteristics
| Compound ID: | 1762-0581 |
| Compound Name: | 3-chloro-N-(3-nitro-5-phenoxyphenyl)-1-benzothiophene-2-carboxamide |
| Molecular Weight: | 424.86 |
| Molecular Formula: | C21 H13 Cl N2 O4 S |
| Smiles: | c1ccc(cc1)Oc1cc(cc(c1)[N+]([O-])=O)NC(c1c(c2ccccc2s1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 6.5078 |
| logD: | 6.467 |
| logSw: | -6.5726 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.206 |
| InChI Key: | RAFOXAAWRHWFDX-UHFFFAOYSA-N |