N-{2-[2-(3,4-dimethylphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]ethyl}-3,5-dimethylbenzamide
Chemical Structure Depiction of
N-{2-[2-(3,4-dimethylphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]ethyl}-3,5-dimethylbenzamide
N-{2-[2-(3,4-dimethylphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]ethyl}-3,5-dimethylbenzamide
Compound characteristics
| Compound ID: | S539-0714 |
| Compound Name: | N-{2-[2-(3,4-dimethylphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]ethyl}-3,5-dimethylbenzamide |
| Molecular Weight: | 414.51 |
| Molecular Formula: | C25 H26 N4 O2 |
| Smiles: | Cc1cc(C)cc(c1)C(NCCN1C=Cn2c(cc(c3ccc(C)c(C)c3)n2)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8008 |
| logD: | 3.8008 |
| logSw: | -3.8364 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.475 |
| InChI Key: | KTHJAVUDEPQQLM-UHFFFAOYSA-N |