N-{2-[2-(3-methoxyphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]ethyl}isoquinoline-1-carboxamide
Chemical Structure Depiction of
N-{2-[2-(3-methoxyphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]ethyl}isoquinoline-1-carboxamide
N-{2-[2-(3-methoxyphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]ethyl}isoquinoline-1-carboxamide
Compound characteristics
| Compound ID: | S539-1055 |
| Compound Name: | N-{2-[2-(3-methoxyphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]ethyl}isoquinoline-1-carboxamide |
| Molecular Weight: | 439.47 |
| Molecular Formula: | C25 H21 N5 O3 |
| Smiles: | COc1cccc(c1)c1cc2C(N(CCNC(c3c4ccccc4ccn3)=O)C=Cn2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1849 |
| logD: | 2.1849 |
| logSw: | -3.0423 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.566 |
| InChI Key: | LVRCCYQNQIHZRE-UHFFFAOYSA-N |