2-chloro-N-{2-[2-(2,5-dimethylphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]ethyl}-6-fluorobenzamide
Chemical Structure Depiction of
2-chloro-N-{2-[2-(2,5-dimethylphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]ethyl}-6-fluorobenzamide
2-chloro-N-{2-[2-(2,5-dimethylphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]ethyl}-6-fluorobenzamide
Compound characteristics
| Compound ID: | S539-0494 |
| Compound Name: | 2-chloro-N-{2-[2-(2,5-dimethylphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]ethyl}-6-fluorobenzamide |
| Molecular Weight: | 438.89 |
| Molecular Formula: | C23 H20 Cl F N4 O2 |
| Smiles: | Cc1ccc(C)c(c1)c1cc2C(N(CCNC(c3c(cccc3[Cl])F)=O)C=Cn2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1468 |
| logD: | 3.1468 |
| logSw: | -3.7589 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.475 |
| InChI Key: | YLNGYMRMFKXGLZ-UHFFFAOYSA-N |