4-{4-[1-methyl-3-(4-methyl-4H-1,2,4-triazol-3-yl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl]-4-oxobutyl}-2-phenyl-2H-pyrido[3,2-b][1,4]oxazin-3(4H)-one
Chemical Structure Depiction of
4-{4-[1-methyl-3-(4-methyl-4H-1,2,4-triazol-3-yl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl]-4-oxobutyl}-2-phenyl-2H-pyrido[3,2-b][1,4]oxazin-3(4H)-one
4-{4-[1-methyl-3-(4-methyl-4H-1,2,4-triazol-3-yl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl]-4-oxobutyl}-2-phenyl-2H-pyrido[3,2-b][1,4]oxazin-3(4H)-one
Compound characteristics
| Compound ID: | S565-1298 |
| Compound Name: | 4-{4-[1-methyl-3-(4-methyl-4H-1,2,4-triazol-3-yl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl]-4-oxobutyl}-2-phenyl-2H-pyrido[3,2-b][1,4]oxazin-3(4H)-one |
| Molecular Weight: | 512.57 |
| Molecular Formula: | C27 H28 N8 O3 |
| Smiles: | Cn1cnnc1c1c2CN(CCc2n(C)n1)C(CCCN1C(C(c2ccccc2)Oc2cccnc12)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.6686 |
| logD: | 0.6634 |
| logSw: | -1.2859 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 89.046 |
| InChI Key: | JAVGEBUNJGBTFQ-DEOSSOPVSA-N |