3-[1-(propan-2-yl)-1H-pyrazole-4-carbonyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Chemical Structure Depiction of
3-[1-(propan-2-yl)-1H-pyrazole-4-carbonyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
3-[1-(propan-2-yl)-1H-pyrazole-4-carbonyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Compound characteristics
| Compound ID: | Y044-5009 |
| Compound Name: | 3-[1-(propan-2-yl)-1H-pyrazole-4-carbonyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one |
| Molecular Weight: | 326.4 |
| Molecular Formula: | C18 H22 N4 O2 |
| Smiles: | CC(C)n1cc(cn1)C(N1C[C@@H]2C[C@H](C1)CN1C2=CC=CC1=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.6425 |
| logD: | 1.6425 |
| logSw: | -1.4095 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 47.547 |
| InChI Key: | FAGSONPDNKZRDN-KBPBESRZSA-N |