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MK-8776 (SCH 900776)

CAT: 0957-S2735-500mgSize: 500 mgDry Ice: YesHazardous: No
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CAT#:0957-S2735-500mgSize:500 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
891494-63-6
Target
CDK
Applications
Cell Cycle
Smiles
CN1C=C (C=N1) C2=C3N=C (C (=C (N3N=C2) N) Br) C4CCCNC4
Molecular Formula
C15H18BrN7
Additionnal Information
MK-8776 (SCH 900776) is a selective Chk1 inhibitor with IC50 of 3 nM in a cell-free assay. It shows 500-fold selectivity against Chk2. Phase 2.
Storage Conditions
2 years -80 in solvent

Chemical Information

Sch-900776

Sch 900776 has been used in trials studying the treatment of Neoplasms, Hodgkin Disease, Adult Erythroleukemia, Lymphoma, Non-Hodgkin, and Myelogenous Leukemia, Acute, among others.

CAS Number891494-63-6
PubChem CID46239015
IUPAC Name6-bromo-3-(1-methylpyrazol-4-yl)-5-[(3R)-piperidin-3-yl]pyrazolo[1,5-a]pyrimidin-7-amine
Molecular FormulaC15H18BrN7
Molecular Weight376.25
XLogP0.8
Topological Polar Surface Area86.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Heavy Atom Count23
Formal Charge0
Complexity425
SMILES
CN1C=C(C=N1)C2=C3N=C(C(=C(N3N=C2)N)Br)[C@@H]4CCCNC4
InChI
InChI=1S/C15H18BrN7/c1-22-8-10(6-19-22)11-7-20-23-14(17)12(16)13(21-15(11)23)9-3-2-4-18-5-9/h6-9,18H,2-5,17H2,1H3/t9-/m1/s1
InChIKey
GMIZZEXBPRLVIV-SECBINFHSA-N
Chemical Structure
2D Structure
2D structure of Sch-900776
CAS: 891494-63-6
CID: 46239015
Formula: C15H18BrN7
MW: 376.25
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight376.25
XLogP30.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Exact Mass375.08071
Monoisotopic Mass375.08071
Topological Polar Surface Area86.1 Ų
Heavy Atom Count23
Formal Charge0
Complexity425
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
A8477-5.1MK-8776 (SCH-900776)
MBS386148-01SCH 900776 (MK-8776)
MBS577174MK-8776 (SCH 900776)
A11167-2SCH 900776 (MK-8776) 2mg
A11167-25SCH 900776 (MK-8776) 25mg
A11167-1SCH 900776 (MK-8776) 1mg
A11167-10mM-DSCH 900776 (MK-8776) 10mM * 1mL in DMSO
sc-364611ASCH 900776
A11167-100SCH 900776 100mg
A11167-50SCH 900776 50mg

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