General Information of the Compound
| Compound ID |
CP0487299
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[dicyclohexyl-[4-(trifluoromethyl)phenyl]methyl]-7,7-dimethyl-5-phenyl-5,6-dihydro-4H-pyrazolo[1,5-a]pyrimidine-3-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C35H43F3N4O
|
||||||||||||||||||
| Molecular Weight |
592.75
|
||||||||||||||||||
| Canonical SMILES |
CC1(C)CC(Nc2c(cnn12)C(=O)NC(C1CCCCC1)(C1CCCCC1)c1ccc(cc1)C(F)(F)F)c1ccccc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C35H43F3N4O/c1-33(2)22-30(24-12-6-3-7-13-24)40-31-29(23-39-42(31)33)32(43)41-34(25-14-8-4-9-15-25,26-16-10-5-11-17-26)27-18-20-28(21-19-27)35(36,37)38/h3,6-7,12-13,18-21,23,25-26,30,40H,4-5,8-11,14-17,22H2,1-2H3,(H,41,43)
Show/Hide
|
||||||||||||||||||
| InChIKey |
TZHIMMVPSIKMOW-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 | |||||||||||||||||||
Map of Molecular Bioactivity Related to the Compound
|
Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
|
|---|
Table of Molecular Bioactivities Related to the Compound