Products for Research Use Only
RegisterLogin

SHIN1

CAT: 0127-BUP08944-01Size: 5 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0127-BUP08944-01Size:5 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
2146095-85-2
Synonyms
RZ-2994
Purity
=98%
Smiles
CC(C)C1(c2c(C)n[nH]c2OC(N)=C1C#N)c1cc(CO)cc(c1)-c1ccccc1

Chemical Information

SHIN 1New
CAS Number2146095-85-2
PubChem CID134335083
IUPAC Name6-amino-4-[3-(hydroxymethyl)-5-phenylphenyl]-3-methyl-4-propan-2-yl-2H-pyrano[2,3-c]pyrazole-5-carbonitrile
Molecular FormulaC24H24N4O2
Molecular Weight400.5
XLogP4.4
Topological Polar Surface Area108
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Heavy Atom Count30
Formal Charge0
Complexity707
SMILES
CC1=C2C(=NN1)OC(=C(C2(C3=CC(=CC(=C3)C4=CC=CC=C4)CO)C(C)C)C#N)N
InChI
InChI=1S/C24H24N4O2/c1-14(2)24(20(12-25)22(26)30-23-21(24)15(3)27-28-23)19-10-16(13-29)9-18(11-19)17-7-5-4-6-8-17/h4-11,14,29H,13,26H2,1-3H3,(H,27,28)
InChIKey
VVVOFJZXKJKHTD-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of SHIN 1New
CAS: 2146095-85-2
CID: 134335083
Formula: C24H24N4O2
MW: 400.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight400.5
XLogP34.4
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass400.18992602
Monoisotopic Mass400.18992602
Topological Polar Surface Area108 Ų
Heavy Atom Count30
Formal Charge0
Complexity707
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
BUP21505-01(Rac) -SHIN2
BAL2385Phospho-SHIP1 (Tyr1020) Rabbit mAb, 1 pack = 20 µL
BAL2387Phospho-SHIP1 (Tyr1020) Rabbit mAb, 1 pack = 100 µL
BAL2386Phospho-SHIP1 (Tyr1020) Rabbit mAb, 1 pack = 50 µL

Alternative Products

CatalogName
BA8348-25SHIN1
HY-112066A-01(+) -SHIN1
T12897-01(-) -SHIN1
MBS5753907(+)-SHIN1
MBS5753905(-)-SHIN1
A19228-50SHIN1 50mg
A19228-25SHIN1 25mg
A19228-5SHIN1 5mg
A19228-1SHIN1 1mg
A19228-100SHIN1 100mg

Popular Products