Products for Research Use Only

BAP1-IN-1

CAT: 1410-M36516-01Size: 1 EachDry Ice: NoHazardous: No
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Description
BAP1-IN-1 is an inhibitor of the catalytic activity of BRCA1-associated protein 1 (BAP1), which is related to cancer and can be used to study cancer.
CAS Number
353495-21-3
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
292.33
Molecular Formula
C18H16N2O2
Notes
Research use only, not for human use.
Receptor
Others

Chemical Information

8-Nitro-4-phenyl-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline
CAS Number353495-21-3
PubChem CID2967505
IUPAC Name8-nitro-4-phenyl-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline
Molecular FormulaC18H16N2O2
Molecular Weight292.3
XLogP4.2
Topological Polar Surface Area57.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Heavy Atom Count22
Formal Charge0
Complexity452
SMILES
C1C=CC2C1C(NC3=C2C=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4
InChI
InChI=1S/C18H16N2O2/c21-20(22)13-9-10-17-16(11-13)14-7-4-8-15(14)18(19-17)12-5-2-1-3-6-12/h1-7,9-11,14-15,18-19H,8H2
InChIKey
FBKCRWSTGRHOGI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 8-Nitro-4-phenyl-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline
CAS: 353495-21-3
CID: 2967505
Formula: C18H16N2O2
MW: 292.3
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight292.3
XLogP34.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass292.121177757
Monoisotopic Mass292.121177757
Topological Polar Surface Area57.9 Ų
Heavy Atom Count22
Formal Charge0
Complexity452
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count3
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes