ethyl 5-[(3-chloro-2-methylphenyl)carbamoyl]-4-methyl-2-(4-methyl-3-nitrobenzamido)thiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 5-[(3-chloro-2-methylphenyl)carbamoyl]-4-methyl-2-(4-methyl-3-nitrobenzamido)thiophene-3-carboxylate
ethyl 5-[(3-chloro-2-methylphenyl)carbamoyl]-4-methyl-2-(4-methyl-3-nitrobenzamido)thiophene-3-carboxylate
Compound characteristics
| Compound ID: | 4223-6942 |
| Compound Name: | ethyl 5-[(3-chloro-2-methylphenyl)carbamoyl]-4-methyl-2-(4-methyl-3-nitrobenzamido)thiophene-3-carboxylate |
| Molecular Weight: | 515.97 |
| Molecular Formula: | C24 H22 Cl N3 O6 S |
| Smiles: | CCOC(c1c(C)c(C(Nc2cccc(c2C)[Cl])=O)sc1NC(c1ccc(C)c(c1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6034 |
| logD: | -0.036 |
| logSw: | -6.1616 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 99.352 |
| InChI Key: | OXAPUDWELQDRQD-UHFFFAOYSA-N |