4-amino-N-(4-ethoxyphenyl)-2-(2-methylanilino)-5-(4-nitrobenzoyl)thiophene-3-carboxamide
Chemical Structure Depiction of
4-amino-N-(4-ethoxyphenyl)-2-(2-methylanilino)-5-(4-nitrobenzoyl)thiophene-3-carboxamide
4-amino-N-(4-ethoxyphenyl)-2-(2-methylanilino)-5-(4-nitrobenzoyl)thiophene-3-carboxamide
Compound characteristics
| Compound ID: | K264-0036 |
| Compound Name: | 4-amino-N-(4-ethoxyphenyl)-2-(2-methylanilino)-5-(4-nitrobenzoyl)thiophene-3-carboxamide |
| Molecular Weight: | 516.58 |
| Molecular Formula: | C27 H24 N4 O5 S |
| Smiles: | CCOc1ccc(cc1)NC(c1c(c(C(c2ccc(cc2)[N+]([O-])=O)=O)sc1Nc1ccccc1C)N)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8981 |
| logD: | 5.8981 |
| logSw: | -5.574 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 104.697 |
| InChI Key: | GVSPCXRWAATVCW-UHFFFAOYSA-N |