4-[7-(4-chlorophenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]-N-[(thiophen-2-yl)methyl]butanamide
Chemical Structure Depiction of
4-[7-(4-chlorophenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]-N-[(thiophen-2-yl)methyl]butanamide
4-[7-(4-chlorophenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]-N-[(thiophen-2-yl)methyl]butanamide
Compound characteristics
Compound ID: | G423-0147 |
Compound Name: | 4-[7-(4-chlorophenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]-N-[(thiophen-2-yl)methyl]butanamide |
Molecular Weight: | 427.91 |
Molecular Formula: | C20 H18 Cl N5 O2 S |
Smiles: | C(CC(NCc1cccs1)=O)Cc1nnc2C(N(C=Cn12)c1ccc(cc1)[Cl])=O |
Stereo: | ACHIRAL |
logP: | 1.4784 |
logD: | 1.4784 |
logSw: | -2.6943 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 64.586 |
InChI Key: | HNRADTYLBBPUFF-UHFFFAOYSA-N |