5-chloro-N-{2-[2-(3,4-dimethylphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]ethyl}-2-fluorobenzamide
Chemical Structure Depiction of
5-chloro-N-{2-[2-(3,4-dimethylphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]ethyl}-2-fluorobenzamide
5-chloro-N-{2-[2-(3,4-dimethylphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]ethyl}-2-fluorobenzamide
Compound characteristics
| Compound ID: | S539-0634 |
| Compound Name: | 5-chloro-N-{2-[2-(3,4-dimethylphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]ethyl}-2-fluorobenzamide |
| Molecular Weight: | 438.89 |
| Molecular Formula: | C23 H20 Cl F N4 O2 |
| Smiles: | Cc1ccc(cc1C)c1cc2C(N(CCNC(c3cc(ccc3F)[Cl])=O)C=Cn2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0371 |
| logD: | 4.0371 |
| logSw: | -4.4951 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.475 |
| InChI Key: | NAJRIRKMDOPBBT-UHFFFAOYSA-N |