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MAT2A inhibitor 2 10mg

CAT: 0628-A20171-10Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0628-A20171-10Size:10 mg
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CAS Number
13299-99-5

Chemical Information

3(2H)-Pyridazinone, 6-(m-methoxyphenyl)-4-methyl-2-(2-morpholinoethyl)-, hydrochloride
CAS Number13299-99-5
PubChem CID202785
IUPAC Name6-(3-methoxyphenyl)-4-methyl-2-(2-morpholin-4-ylethyl)pyridazin-3-one;hydrochloride
Molecular FormulaC18H24ClN3O3
Molecular Weight365.9
Topological Polar Surface Area54.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Heavy Atom Count25
Formal Charge0
Complexity512
SMILES
CC1=CC(=NN(C1=O)CCN2CCOCC2)C3=CC(=CC=C3)OC.Cl
InChI
InChI=1S/C18H23N3O3.ClH/c1-14-12-17(15-4-3-5-16(13-15)23-2)19-21(18(14)22)7-6-20-8-10-24-11-9-20;/h3-5,12-13H,6-11H2,1-2H3;1H
InChIKey
REOUTEBTFSILJY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3(2H)-Pyridazinone, 6-(m-methoxyphenyl)-4-methyl-2-(2-morpholinoethyl)-, hydrochloride
CAS: 13299-99-5
CID: 202785
Formula: C18H24ClN3O3
MW: 365.9
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight365.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Exact Mass365.1506193
Monoisotopic Mass365.1506193
Topological Polar Surface Area54.4 Ų
Heavy Atom Count25
Formal Charge0
Complexity512
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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