N-{2-[2-(2,4-dimethylphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]ethyl}-2,5-difluorobenzamide
Chemical Structure Depiction of
N-{2-[2-(2,4-dimethylphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]ethyl}-2,5-difluorobenzamide
N-{2-[2-(2,4-dimethylphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]ethyl}-2,5-difluorobenzamide
Compound characteristics
| Compound ID: | S539-0389 |
| Compound Name: | N-{2-[2-(2,4-dimethylphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]ethyl}-2,5-difluorobenzamide |
| Molecular Weight: | 422.43 |
| Molecular Formula: | C23 H20 F2 N4 O2 |
| Smiles: | Cc1ccc(c(C)c1)c1cc2C(N(CCNC(c3cc(ccc3F)F)=O)C=Cn2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.414 |
| logD: | 3.414 |
| logSw: | -3.5558 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.475 |
| InChI Key: | XLIWVNLGCLBQFM-UHFFFAOYSA-N |