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GS-626510

CAT: 0607-BA4730-5.1Size: 1 mL (10 mM in DMSO)Dry Ice: NoHazardous: No
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CAT#:0607-BA4730-5.1Size:1 mL (10 mM in DMSO)
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1637770-13-8
Form
A solid
Molecular Formula
C25H22N4O
Molecular Weight
394.47
Shipping Conditions
Blue ice
Storage Conditions
-20°C.

Chemical Information

4-(2-cyclopropyl-7-(6-methylquinolin-5-yl)-1H-benzo[d]imidazol-5-yl)-3,5-dimethylisoxazole
CAS Number1637770-13-8
PubChem CID86301666
IUPAC Name4-[2-cyclopropyl-7-(6-methylquinolin-5-yl)-3H-benzimidazol-5-yl]-3,5-dimethyl-1,2-oxazole
Molecular FormulaC25H22N4O
Molecular Weight394.5
XLogP5.2
Topological Polar Surface Area67.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Heavy Atom Count30
Formal Charge0
Complexity626
SMILES
CC1=C(C2=C(C=C1)N=CC=C2)C3=C4C(=CC(=C3)C5=C(ON=C5C)C)NC(=N4)C6CC6
InChI
InChI=1S/C25H22N4O/c1-13-6-9-20-18(5-4-10-26-20)22(13)19-11-17(23-14(2)29-30-15(23)3)12-21-24(19)28-25(27-21)16-7-8-16/h4-6,9-12,16H,7-8H2,1-3H3,(H,27,28)
InChIKey
KHQQNXFBTALTQF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-(2-cyclopropyl-7-(6-methylquinolin-5-yl)-1H-benzo[d]imidazol-5-yl)-3,5-dimethylisoxazole
CAS: 1637770-13-8
CID: 86301666
Formula: C25H22N4O
MW: 394.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight394.5
XLogP35.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass394.17936134
Monoisotopic Mass394.17936134
Topological Polar Surface Area67.6 Ų
Heavy Atom Count30
Formal Charge0
Complexity626
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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Alternative Products

CatalogName
GTR19203821-01GS-626510
A13305-100GS-626510 100mg
A13305-25GS-626510 25mg
A13305-5GS-626510 5mg
A13305-50GS-626510 50mg
A13305-10GS-626510 10mg
A13305-1GS-626510 1mg
A13305-10mM-DGS-626510 10mM * 1mL in DMSO
MBS131349Selonsertib (GS-4997; GS4997; GS 4997)
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