MMPIP

CAT: 0926-FM65091-02Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0926-FM65091-02Size:50 mg

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CAS Number

479077-02-6

Smiles

CN1C (=CC2=C (C1=O) C (=NO2) C3=CC=NC=C3) C4=CC=C (C=C4) OC

Molecular Formula

C19H15N3O3

Molecular Weight

333.34 g/mol

Controlled

Chemical Information

Mmpip

CAS Number	479077-02-6
PubChem CID	9945530
IUPAC Name	6-(4-methoxyphenyl)-5-methyl-3-pyridin-4-yl-[1,2]oxazolo[4,5-c]pyridin-4-one
Molecular Formula	C19H15N3O3
Molecular Weight	333.3
XLogP	2.2
Topological Polar Surface Area	68.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	3
Heavy Atom Count	25
Formal Charge	0
Complexity	524

SMILES

CN1C(=CC2=C(C1=O)C(=NO2)C3=CC=NC=C3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C19H15N3O3/c1-22-15(12-3-5-14(24-2)6-4-12)11-16-17(19(22)23)18(21-25-16)13-7-9-20-10-8-13/h3-11H,1-2H3

InChIKey

PDWYBOZNEVALOV-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 479077-02-6

CID: 9945530

Formula: C19H15N3O3

MW: 333.3

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	333.3
XLogP3	2.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	3
Exact Mass	333.11134135
Monoisotopic Mass	333.11134135
Topological Polar Surface Area	68.5 Å²
Heavy Atom Count	25
Formal Charge	0
Complexity	524
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
HFC72247-01	MMPI-1154

Catalog	Name
GTR19201121-01	MMPIP
T23008L-01	MMPIP hydrochloride
563212	MMPIP HCl
HY-103111-01	MMPIP (hydrochloride)
217562	MMPIP (6- (4-Methoxyphenyl) -5-methyl-3- (4-pyridinyl) -isoxazolo[ 4,5-c]pyridin-4 (5H) -one)