2-(2-chloro-5-nitrobenzamido)-N-(2-methoxyphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Chemical Structure Depiction of
2-(2-chloro-5-nitrobenzamido)-N-(2-methoxyphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
2-(2-chloro-5-nitrobenzamido)-N-(2-methoxyphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Compound characteristics
| Compound ID: | 3261-1116 |
| Compound Name: | 2-(2-chloro-5-nitrobenzamido)-N-(2-methoxyphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide |
| Molecular Weight: | 485.94 |
| Molecular Formula: | C23 H20 Cl N3 O5 S |
| Smiles: | COc1ccccc1NC(c1c2CCCCc2sc1NC(c1cc(ccc1[Cl])[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4654 |
| logD: | 2.317 |
| logSw: | -6.0627 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.45 |
| InChI Key: | LUAWTUOMNPBPAN-UHFFFAOYSA-N |