4-fluoro-N-{2-[2-(3-methoxyphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]ethyl}benzamide
Chemical Structure Depiction of
4-fluoro-N-{2-[2-(3-methoxyphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]ethyl}benzamide
4-fluoro-N-{2-[2-(3-methoxyphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]ethyl}benzamide
Compound characteristics
| Compound ID: | S539-1085 |
| Compound Name: | 4-fluoro-N-{2-[2-(3-methoxyphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]ethyl}benzamide |
| Molecular Weight: | 406.42 |
| Molecular Formula: | C22 H19 F N4 O3 |
| Smiles: | COc1cccc(c1)c1cc2C(N(CCNC(c3ccc(cc3)F)=O)C=Cn2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.056 |
| logD: | 2.056 |
| logSw: | -2.7631 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.019 |
| InChI Key: | PQQIAEQSIZQRJI-UHFFFAOYSA-N |