methyl 2-({1-[(2-chlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}carbamamido)-5-methylthiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-({1-[(2-chlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}carbamamido)-5-methylthiophene-3-carboxylate
methyl 2-({1-[(2-chlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}carbamamido)-5-methylthiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y206-9896 |
| Compound Name: | methyl 2-({1-[(2-chlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}carbamamido)-5-methylthiophene-3-carboxylate |
| Molecular Weight: | 432.93 |
| Molecular Formula: | C20 H21 Cl N4 O3 S |
| Smiles: | Cc1c(c(C)n(Cc2ccccc2[Cl])n1)NC(Nc1c(cc(C)s1)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0263 |
| logD: | 3.1171 |
| logSw: | -4.4297 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.396 |
| InChI Key: | ABWKXFLJSFHUGW-UHFFFAOYSA-N |