3-cyano-N-{2-[2-(2,4-dimethylphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]ethyl}benzamide
Chemical Structure Depiction of
3-cyano-N-{2-[2-(2,4-dimethylphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]ethyl}benzamide
3-cyano-N-{2-[2-(2,4-dimethylphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]ethyl}benzamide
Compound characteristics
| Compound ID: | S539-0391 |
| Compound Name: | 3-cyano-N-{2-[2-(2,4-dimethylphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]ethyl}benzamide |
| Molecular Weight: | 411.46 |
| Molecular Formula: | C24 H21 N5 O2 |
| Smiles: | Cc1ccc(c(C)c1)c1cc2C(N(CCNC(c3cccc(C#N)c3)=O)C=Cn2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.404 |
| logD: | 2.404 |
| logSw: | -2.7794 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.532 |
| InChI Key: | JQGCKMQWVRPQKI-UHFFFAOYSA-N |