2-[1-(2,5-dimethylfuran-3-carbonyl)piperidin-3-yl]-5-(2-methoxyethyl)-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepin-4-one
Chemical Structure Depiction of
2-[1-(2,5-dimethylfuran-3-carbonyl)piperidin-3-yl]-5-(2-methoxyethyl)-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepin-4-one
2-[1-(2,5-dimethylfuran-3-carbonyl)piperidin-3-yl]-5-(2-methoxyethyl)-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepin-4-one
Compound characteristics
| Compound ID: | P223-1175 |
| Compound Name: | 2-[1-(2,5-dimethylfuran-3-carbonyl)piperidin-3-yl]-5-(2-methoxyethyl)-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepin-4-one |
| Molecular Weight: | 414.5 |
| Molecular Formula: | C22 H30 N4 O4 |
| Smiles: | Cc1cc(C(N2CCCC(C2)c2cc3C(N(CCCn3n2)CCOC)=O)=O)c(C)o1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.5266 |
| logD: | 1.5266 |
| logSw: | -1.8202 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 63.031 |
| InChI Key: | GXRLIOWCCGCZAV-KRWDZBQOSA-N |