N-[3-(methylsulfanyl)phenyl]-2-[3-oxo-8-(4-phenylpiperazin-1-yl)[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]acetamide
Chemical Structure Depiction of
N-[3-(methylsulfanyl)phenyl]-2-[3-oxo-8-(4-phenylpiperazin-1-yl)[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]acetamide
N-[3-(methylsulfanyl)phenyl]-2-[3-oxo-8-(4-phenylpiperazin-1-yl)[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]acetamide
Compound characteristics
| Compound ID: | M460-4003 |
| Compound Name: | N-[3-(methylsulfanyl)phenyl]-2-[3-oxo-8-(4-phenylpiperazin-1-yl)[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]acetamide |
| Molecular Weight: | 475.57 |
| Molecular Formula: | C24 H25 N7 O2 S |
| Smiles: | CSc1cccc(c1)NC(CN1C(N2C=CN=C(C2=N1)N1CCN(CC1)c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7505 |
| logD: | 2.7505 |
| logSw: | -3.2505 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.469 |
| InChI Key: | RQHISMVCTJZJNJ-UHFFFAOYSA-N |