2-chloro-4-fluoro-N-{2-[2-(4-methoxyphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]ethyl}benzamide
Chemical Structure Depiction of
2-chloro-4-fluoro-N-{2-[2-(4-methoxyphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]ethyl}benzamide
2-chloro-4-fluoro-N-{2-[2-(4-methoxyphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]ethyl}benzamide
Compound characteristics
| Compound ID: | S539-0160 |
| Compound Name: | 2-chloro-4-fluoro-N-{2-[2-(4-methoxyphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]ethyl}benzamide |
| Molecular Weight: | 440.86 |
| Molecular Formula: | C22 H18 Cl F N4 O3 |
| Smiles: | COc1ccc(cc1)c1cc2C(N(CCNC(c3ccc(cc3[Cl])F)=O)C=Cn2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0354 |
| logD: | 3.0354 |
| logSw: | -3.7252 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.019 |
| InChI Key: | YQBKPTCOPFVRKQ-UHFFFAOYSA-N |