propan-2-yl 4-carbamoyl-3-methyl-5-(3-methyl-4-nitrobenzamido)thiophene-2-carboxylate
Chemical Structure Depiction of
propan-2-yl 4-carbamoyl-3-methyl-5-(3-methyl-4-nitrobenzamido)thiophene-2-carboxylate
propan-2-yl 4-carbamoyl-3-methyl-5-(3-methyl-4-nitrobenzamido)thiophene-2-carboxylate
Compound characteristics
| Compound ID: | Y203-8537 |
| Compound Name: | propan-2-yl 4-carbamoyl-3-methyl-5-(3-methyl-4-nitrobenzamido)thiophene-2-carboxylate |
| Molecular Weight: | 405.43 |
| Molecular Formula: | C18 H19 N3 O6 S |
| Smiles: | CC(C)OC(c1c(C)c(C(N)=O)c(NC(c2ccc(c(C)c2)[N+]([O-])=O)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2218 |
| logD: | 0.1235 |
| logSw: | -2.9228 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 110.696 |
| InChI Key: | YEGLYOGRBAADRG-UHFFFAOYSA-N |