ML 281

CAT: 0926-EGC43762-02Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0926-EGC43762-02Size:100 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

1404437-62-2

MDL Number

MFCD25976601

Smiles

CC (C) C1=CC (=C (C=C1) NC (=O) C2=CC=CS2) C3=NC4=CC=CC=C4NC3=O

Molecular Formula

C22H19N3O2S

Molecular Weight

389.47 g/mol

Controlled

Chemical Information

N-(4-isopropyl-2-(3-oxo-3,4-dihydroquinoxalin-2-yl)phenyl)thiophene-2-carboxamide

N-[2-(3-oxo-4H-quinoxalin-2-yl)-4-propan-2-ylphenyl]-2-thiophenecarboxamide is an aromatic amide.

CAS Number	1404437-62-2
PubChem CID	53377448
IUPAC Name	N-[2-(3-oxo-4H-quinoxalin-2-yl)-4-propan-2-ylphenyl]thiophene-2-carboxamide
Molecular Formula	C22H19N3O2S
Molecular Weight	389.5
XLogP	4.3
Topological Polar Surface Area	98.8
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Heavy Atom Count	28
Formal Charge	0
Complexity	635

SMILES

CC(C)C1=CC(=C(C=C1)NC(=O)C2=CC=CS2)C3=NC4=CC=CC=C4NC3=O

InChI

InChI=1S/C22H19N3O2S/c1-13(2)14-9-10-16(24-21(26)19-8-5-11-28-19)15(12-14)20-22(27)25-18-7-4-3-6-17(18)23-20/h3-13H,1-2H3,(H,24,26)(H,25,27)

InChIKey

HWOYIOLMBQSTQS-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1404437-62-2

CID: 53377448

Formula: C22H19N3O2S

MW: 389.5

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	389.5
XLogP3	4.3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Exact Mass	389.11979803
Monoisotopic Mass	389.11979803
Topological Polar Surface Area	98.8 Å²
Heavy Atom Count	28
Formal Charge	0
Complexity	635
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	1
Compound Is Canonicalized	Yes

Catalog	Name
CIA46368-01	AM 281
VAC-00600-01	[Ala286]-Calmodulin-Dependent Protein Kinase II (281-302) ((Ala286) -CaMK-II (281-302) )
CRB1001466-01	EBV EBNA3C (281-290) (HLA-B44)
VAC-00601-01	Calmodulin-Dependent Protein Kinase II (281-309)
JDC52614-01	(±) -ML 209
FEC24402	ML 190
BM171106-01	ML 792
BM166458-01	ML 323
BHC57680-01	ML-243
RYB89716-01	ML-10

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122-101	ExgeneTM Forensic SV mini
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