General Information of the Compound
| Compound ID |
CP0859215
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
3-(10-Oxo-4,8-diphenyl-10H-pyrano[4',3':3,4]pyrazolo[1,5-a]pyrimidin-7-yl)benzamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C28H18N4O3
|
||||||||||||||||||
| Molecular Weight |
458.477
|
||||||||||||||||||
| Canonical SMILES |
NC(=O)c1cccc(-c2c(-c3ccccc3)oc(=O)c3c2nn2c(-c4ccccc4)ccnc32)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C28H18N4O3/c29-26(33)20-13-7-12-19(16-20)22-24-23(28(34)35-25(22)18-10-5-2-6-11-18)27-30-15-14-21(32(27)31-24)17-8-3-1-4-9-17/h1-16H,(H2,29,33)
Show/Hide
|
||||||||||||||||||
| InChIKey |
UOFLHEQJZGXBMJ-UHFFFAOYSA-N
|
||||||||||||||||||
| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
|
||||||||||||||||||
| Click to Show/Hide the External Link(s) of This Compound | |||||||||||||||||||
| PubChem ID | |||||||||||||||||||
| ChEMBL ID | |||||||||||||||||||