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BMS-502

CAT: 1410-M37109-01Size: 1 EachDry Ice: NoHazardous: No
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Description
BMS-502 is a potent dual inhibitor of diacylglycerol kinase (DGK) α and ζ that induces immune responses in human and mouse T cells and blocks intracellular checkpoint signaling in T cells. BMS-502 stimulates immune responses in a dose-dependent manner and can be used to study immune-related diseases.
CAS Number
2407854-18-4
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
516.5
Molecular Formula
C27H22F2N6O3
Notes
Research use only, not for human use.
Receptor
Others

Chemical Information

8-(4-(Bis(4-fluorophenyl)methyl)piperazin-1-yl)-5-methyl-7-nitro-6-oxo-5,6-dihydro-1,5-naphthyridine-2-carbonitrile
CAS Number2407854-18-4
PubChem CID146466271
IUPAC Name8-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-5-methyl-7-nitro-6-oxo-1,5-naphthyridine-2-carbonitrile
Molecular FormulaC27H22F2N6O3
Molecular Weight516.5
XLogP3.6
Topological Polar Surface Area109
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count9
Rotatable Bond Count4
Heavy Atom Count38
Formal Charge0
Complexity949
SMILES
CN1C2=C(C(=C(C1=O)[N+](=O)[O-])N3CCN(CC3)C(C4=CC=C(C=C4)F)C5=CC=C(C=C5)F)N=C(C=C2)C#N
InChI
InChI=1S/C27H22F2N6O3/c1-32-22-11-10-21(16-30)31-23(22)25(26(27(32)36)35(37)38)34-14-12-33(13-15-34)24(17-2-6-19(28)7-3-17)18-4-8-20(29)9-5-18/h2-11,24H,12-15H2,1H3
InChIKey
XAHMIJCNFUSTMT-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 8-(4-(Bis(4-fluorophenyl)methyl)piperazin-1-yl)-5-methyl-7-nitro-6-oxo-5,6-dihydro-1,5-naphthyridine-2-carbonitrile
CAS: 2407854-18-4
CID: 146466271
Formula: C27H22F2N6O3
MW: 516.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight516.5
XLogP33.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count9
Rotatable Bond Count4
Exact Mass516.17214491
Monoisotopic Mass516.17214491
Topological Polar Surface Area109 Ų
Heavy Atom Count38
Formal Charge0
Complexity949
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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BA7293-1BMS-502
C5478-5NCT-502
T69586-01SPD 502
HY-123922NOSO-502
HY-15074SPD-502
T23827-01BTG 502
GTR19273746-01NIP 502
HY-132294-01GNE-502
HY-124065ARRY-502

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