methyl 2-(2-methyl-3-nitrobenzamido)-4-(4-methylphenyl)thiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-(2-methyl-3-nitrobenzamido)-4-(4-methylphenyl)thiophene-3-carboxylate
methyl 2-(2-methyl-3-nitrobenzamido)-4-(4-methylphenyl)thiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y500-9424 |
| Compound Name: | methyl 2-(2-methyl-3-nitrobenzamido)-4-(4-methylphenyl)thiophene-3-carboxylate |
| Molecular Weight: | 410.45 |
| Molecular Formula: | C21 H18 N2 O5 S |
| Smiles: | Cc1ccc(cc1)c1csc(c1C(=O)OC)NC(c1cccc(c1C)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9485 |
| logD: | 3.247 |
| logSw: | -4.8128 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.107 |
| InChI Key: | FVNOEUBQAFGLTB-UHFFFAOYSA-N |