N-[3-cyano-4-(2,4-dichlorophenyl)thiophen-2-yl]-1-methyl-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
N-[3-cyano-4-(2,4-dichlorophenyl)thiophen-2-yl]-1-methyl-1H-pyrazole-5-carboxamide
N-[3-cyano-4-(2,4-dichlorophenyl)thiophen-2-yl]-1-methyl-1H-pyrazole-5-carboxamide
Compound characteristics
Compound ID: | Y202-7419 |
Compound Name: | N-[3-cyano-4-(2,4-dichlorophenyl)thiophen-2-yl]-1-methyl-1H-pyrazole-5-carboxamide |
Molecular Weight: | 377.25 |
Molecular Formula: | C16 H10 Cl2 N4 O S |
Smiles: | Cn1c(ccn1)C(Nc1c(C#N)c(cs1)c1ccc(cc1[Cl])[Cl])=O |
Stereo: | ACHIRAL |
logP: | 3.7596 |
logD: | 3.4612 |
logSw: | -4.5417 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 53.559 |
InChI Key: | LFIFLYSIVBHWFL-UHFFFAOYSA-N |