4-[7-(4-chlorophenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]-N-[2-(pyrrolidin-1-yl)ethyl]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-[2-(pyrrolidin-1-yl)ethyl]butanamide
4-[7-(4-chlorophenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]-N-[2-(pyrrolidin-1-yl)ethyl]butanamide
Compound characteristics
| Compound ID: | G423-0156 |
| Compound Name: | 4-[7-(4-chlorophenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]-N-[2-(pyrrolidin-1-yl)ethyl]butanamide |
| Molecular Weight: | 428.92 |
| Molecular Formula: | C21 H25 Cl N6 O2 |
| Smiles: | C(CC(NCCN1CCCC1)=O)Cc1nnc2C(N(C=Cn12)c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 0.1595 |
| logD: | -1.9961 |
| logSw: | -2.2194 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.758 |
| InChI Key: | LSQRMCYRKJWDMT-UHFFFAOYSA-N |