MAT2A inhibitor 2 500mg

CAT: 0628-A20171-500Size: 500 mgDry Ice: NoHazardous: No

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CAT#:0628-A20171-500Size:500 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 Number	13299-99-5
PubChem CID	202785
IUPAC Name	6-(3-methoxyphenyl)-4-methyl-2-(2-morpholin-4-ylethyl)pyridazin-3-one;hydrochloride
Molecular Formula	C18H24ClN3O3
Molecular Weight	365.9
Topological Polar Surface Area	54.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	5
Heavy Atom Count	25
Formal Charge	0
Complexity	512

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

CAS: 13299-99-5

CID: 202785

Formula: C18H24ClN3O3

MW: 365.9

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	365.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	5
Exact Mass	365.1506193
Monoisotopic Mass	365.1506193
Topological Polar Surface Area	54.4 Å²
Heavy Atom Count	25
Formal Charge	0
Complexity	512
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	2
Compound Is Canonicalized	Yes