3-[4-(2-chlorophenyl)piperazine-1-sulfonyl]-N-(prop-2-en-1-yl)-1-propyl-1H-pyrazole-4-carboxamide
Chemical Structure Depiction of
3-[4-(2-chlorophenyl)piperazine-1-sulfonyl]-N-(prop-2-en-1-yl)-1-propyl-1H-pyrazole-4-carboxamide
3-[4-(2-chlorophenyl)piperazine-1-sulfonyl]-N-(prop-2-en-1-yl)-1-propyl-1H-pyrazole-4-carboxamide
Compound characteristics
Compound ID: | M461-6102 |
Compound Name: | 3-[4-(2-chlorophenyl)piperazine-1-sulfonyl]-N-(prop-2-en-1-yl)-1-propyl-1H-pyrazole-4-carboxamide |
Molecular Weight: | 451.97 |
Molecular Formula: | C20 H26 Cl N5 O3 S |
Smiles: | CCCn1cc(C(NCC=C)=O)c(n1)S(N1CCN(CC1)c1ccccc1[Cl])(=O)=O |
Stereo: | ACHIRAL |
logP: | 2.7505 |
logD: | 2.7504 |
logSw: | -3.6355 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 74.512 |
InChI Key: | IIZGLJBVWZXHKE-UHFFFAOYSA-N |