ZEN-3219

CAT: 0607-BA4754-5Size: 5 mgDry Ice: NoHazardous: No

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CAT#:0607-BA4754-5Size:5 mg

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

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CAS Number

1952264-34-4

Form

A solid

Molecular Formula

C19H18N2O3

Molecular Weight

322.36

Shipping Conditions

Blue ice

Storage Conditions

-20°C.

Chemical Information

CID 121414852

CAS Number	1952264-34-4
PubChem CID	121414852
IUPAC Name	5-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[[4-(oxiran-2-yl)phenyl]methyl]pyridin-2-one
Molecular Formula	C19H18N2O3
Molecular Weight	322.4
XLogP	1.8
Topological Polar Surface Area	58.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Heavy Atom Count	24
Formal Charge	0
Complexity	551

SMILES

CC1=C(C(=NO1)C)C2=CN(C(=O)C=C2)CC3=CC=C(C=C3)C4CO4

InChI

InChI=1S/C19H18N2O3/c1-12-19(13(2)24-20-12)16-7-8-18(22)21(10-16)9-14-3-5-15(6-4-14)17-11-23-17/h3-8,10,17H,9,11H2,1-2H3

InChIKey

IELJHNIVCXDKQD-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1952264-34-4

CID: 121414852

Formula: C19H18N2O3

MW: 322.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	322.4
XLogP3	1.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Exact Mass	322.13174244
Monoisotopic Mass	322.13174244
Topological Polar Surface Area	58.9 Å²
Heavy Atom Count	24
Formal Charge	0
Complexity	551
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes