N-{2-[2-(4-ethoxyphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]ethyl}-2-fluorobenzamide
Chemical Structure Depiction of
N-{2-[2-(4-ethoxyphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]ethyl}-2-fluorobenzamide
N-{2-[2-(4-ethoxyphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]ethyl}-2-fluorobenzamide
Compound characteristics
| Compound ID: | S539-0312 |
| Compound Name: | N-{2-[2-(4-ethoxyphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]ethyl}-2-fluorobenzamide |
| Molecular Weight: | 420.44 |
| Molecular Formula: | C23 H21 F N4 O3 |
| Smiles: | CCOc1ccc(cc1)c1cc2C(N(CCNC(c3ccccc3F)=O)C=Cn2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.738 |
| logD: | 2.738 |
| logSw: | -3.3569 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.599 |
| InChI Key: | NGCMXSHPEWTMHY-UHFFFAOYSA-N |