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AMG PERK 44

CAT: 0127-BUP00480-06Size: 200 mgDry Ice: NoHazardous: No
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CAT#:0127-BUP00480-06Size:200 mg
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CAS Number
1883548-84-2
Purity
=98%
Smiles
Cl.Cc1ccc2cc(ccc2n1)-c1c(C)ccc(C(=O)c2c(-c3ccccc3)n(C)n(-c3ccccc3)c2=O)c1N

Chemical Information

Amg perk 44
CAS Number1883548-84-2
PubChem CID121513867
IUPAC Name4-[2-amino-4-methyl-3-(2-methylquinolin-6-yl)benzoyl]-1-methyl-2,5-diphenylpyrazol-3-one;hydrochloride
Molecular FormulaC34H29ClN4O2
Molecular Weight561.1
Topological Polar Surface Area79.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Heavy Atom Count41
Formal Charge0
Complexity967
SMILES
CC1=C(C(=C(C=C1)C(=O)C2=C(N(N(C2=O)C3=CC=CC=C3)C)C4=CC=CC=C4)N)C5=CC6=C(C=C5)N=C(C=C6)C.Cl
InChI
InChI=1S/C34H28N4O2.ClH/c1-21-14-18-27(31(35)29(21)25-17-19-28-24(20-25)16-15-22(2)36-28)33(39)30-32(23-10-6-4-7-11-23)37(3)38(34(30)40)26-12-8-5-9-13-26;/h4-20H,35H2,1-3H3;1H
InChIKey
RNAKBTDDCHJCMT-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Amg perk 44
CAS: 1883548-84-2
CID: 121513867
Formula: C34H29ClN4O2
MW: 561.1
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight561.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Exact Mass560.1979039
Monoisotopic Mass560.1979039
Topological Polar Surface Area79.5 Ų
Heavy Atom Count41
Formal Charge0
Complexity967
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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