Products for Research Use Only
RegisterLogin

G907

CAT: 0926-UPD03516-02Size: 25 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0926-UPD03516-02Size:25 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
2244035-16-1
Smiles
CC (C1=C (C=CC=C1Cl) C2CC2) OC3=CC4=C (C (=CN=C4C=C3) C=CC (=O) O) C5CC5
Molecular Formula
C26H24ClNO3
Molecular Weight
433.9 g/mol
Controlled
No

Chemical Information

(E)-3-[6-[1-(2-Chloro-6-cyclopropylphenyl)ethoxy]-4-cyclopropylquinolin-3-yl]prop-2-enoic acid
CAS Number2244035-16-1
PubChem CID139035046
IUPAC Name(E)-3-[6-[1-(2-chloro-6-cyclopropylphenyl)ethoxy]-4-cyclopropylquinolin-3-yl]prop-2-enoic acid
Molecular FormulaC26H24ClNO3
Molecular Weight433.9
XLogP6.5
Topological Polar Surface Area59.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count7
Heavy Atom Count31
Formal Charge0
Complexity676
SMILES
CC(C1=C(C=CC=C1Cl)C2CC2)OC3=CC4=C(C(=CN=C4C=C3)/C=C/C(=O)O)C5CC5
InChI
InChI=1S/C26H24ClNO3/c1-15(25-20(16-5-6-16)3-2-4-22(25)27)31-19-10-11-23-21(13-19)26(17-7-8-17)18(14-28-23)9-12-24(29)30/h2-4,9-17H,5-8H2,1H3,(H,29,30)/b12-9+
InChIKey
HOMQCLNBKVHZGD-FMIVXFBMSA-N
Chemical Structure
2D Structure
2D structure of (E)-3-[6-[1-(2-Chloro-6-cyclopropylphenyl)ethoxy]-4-cyclopropylquinolin-3-yl]prop-2-enoic acid
CAS: 2244035-16-1
CID: 139035046
Formula: C26H24ClNO3
MW: 433.9
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight433.9
XLogP36.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count7
Exact Mass433.1444713
Monoisotopic Mass433.1444713
Topological Polar Surface Area59.4 Ų
Heavy Atom Count31
Formal Charge0
Complexity676
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
BA1294-5G907
A18540-100G907 100mg
A18540-50G907 50mg
A18540-1G907 1mg
A18540-10G907 10mg
M32932-01G907 B
A18540-5G907 5mg

Popular Products