methyl 3-chloro-6-[3-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-2-methylpropanamido]-1-benzothiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-chloro-6-[3-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-2-methylpropanamido]-1-benzothiophene-2-carboxylate
methyl 3-chloro-6-[3-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-2-methylpropanamido]-1-benzothiophene-2-carboxylate
Compound characteristics
| Compound ID: | Y501-7350 |
| Compound Name: | methyl 3-chloro-6-[3-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-2-methylpropanamido]-1-benzothiophene-2-carboxylate |
| Molecular Weight: | 440.35 |
| Molecular Formula: | C19 H19 Cl2 N3 O3 S |
| Smiles: | CC(Cn1c(C)c(c(C)n1)[Cl])C(Nc1ccc2c(c(C(=O)OC)sc2c1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3371 |
| logD: | 4.3359 |
| logSw: | -4.6368 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.804 |
| InChI Key: | HABYUWUMHZAUEW-VIFPVBQESA-N |