3-chloro-N-{2-[2-(3-methoxyphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]ethyl}benzamide
Chemical Structure Depiction of
3-chloro-N-{2-[2-(3-methoxyphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]ethyl}benzamide
3-chloro-N-{2-[2-(3-methoxyphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]ethyl}benzamide
Compound characteristics
| Compound ID: | S539-1080 |
| Compound Name: | 3-chloro-N-{2-[2-(3-methoxyphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]ethyl}benzamide |
| Molecular Weight: | 422.87 |
| Molecular Formula: | C22 H19 Cl N4 O3 |
| Smiles: | COc1cccc(c1)c1cc2C(N(CCNC(c3cccc(c3)[Cl])=O)C=Cn2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6897 |
| logD: | 2.6897 |
| logSw: | -3.6291 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.019 |
| InChI Key: | NSJRWSYOJIGFBF-UHFFFAOYSA-N |