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Cloricromen hydrochloride

CAT: 0931-T68761-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T68761-01Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
74697-28-2
Target
Others
Related Pathways
Others
Bioactivity
Cloricromen hydrochloride, also known as Cloricromene hydrochloride, is a compound that functions as a platelet aggregation inhibitor, effectively preventing platelet aggregation in both humans and experimental thrombosis scenarios.
Smiles
Cl.O=C1OC=2C(Cl)=C(OCC(=O)OCC)C=CC2C(=C1CCN(CC)CC)C
Molecular Formula
C20H27Cl2NO5
Molecular Weight
432.34
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Cloricromen hydrochloride
CAS Number74697-28-2
PubChem CID16219127
IUPAC Nameethyl 2-[8-chloro-3-[2-(diethylamino)ethyl]-4-methyl-2-oxochromen-7-yl]oxyacetate;hydrochloride
Molecular FormulaC20H27Cl2NO5
Molecular Weight432.3
Topological Polar Surface Area65.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count10
Heavy Atom Count28
Formal Charge0
Complexity561
SMILES
CCN(CC)CCC1=C(C2=C(C(=C(C=C2)OCC(=O)OCC)Cl)OC1=O)C.Cl
InChI
InChI=1S/C20H26ClNO5.ClH/c1-5-22(6-2)11-10-15-13(4)14-8-9-16(26-12-17(23)25-7-3)18(21)19(14)27-20(15)24;/h8-9H,5-7,10-12H2,1-4H3;1H
InChIKey
CCCZJRFQJNGCCU-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Cloricromen hydrochloride
CAS: 74697-28-2
CID: 16219127
Formula: C20H27Cl2NO5
MW: 432.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight432.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count10
Exact Mass431.1266283
Monoisotopic Mass431.1266283
Topological Polar Surface Area65.1 Ų
Heavy Atom Count28
Formal Charge0
Complexity561
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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