KDM4C-IN-1

CAT: 0607-BA4793-50Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0607-BA4793-50Size:50 mg

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

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CAS Number

52348-60-4

Form

A solid

Molecular Formula

C14H13N5O3

Molecular Weight

299.28

Shipping Conditions

Blue ice

Storage Conditions

-20°C.

Chemical Information

Kdm4C-IN-1

CAS Number	52348-60-4
PubChem CID	823993
IUPAC Name	3-(4-methoxyphenyl)-1,6-dimethylpyrimido[5,4-e][1,2,4]triazine-5,7-dione
Molecular Formula	C14H13N5O3
Molecular Weight	299.28
XLogP	1
Topological Polar Surface Area	86.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	2
Heavy Atom Count	22
Formal Charge	0
Complexity	602

SMILES

CN1C2=NC(=O)N(C(=O)C2=NC(=N1)C3=CC=C(C=C3)OC)C

InChI

InChI=1S/C14H13N5O3/c1-18-13(20)10-12(16-14(18)21)19(2)17-11(15-10)8-4-6-9(22-3)7-5-8/h4-7H,1-3H3

InChIKey

BVFGFWOGCVXIFG-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 52348-60-4

CID: 823993

Formula: C14H13N5O3

MW: 299.28

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	299.28
XLogP3	1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	2
Exact Mass	299.10183929
Monoisotopic Mass	299.10183929
Topological Polar Surface Area	86.9 Å²
Heavy Atom Count	22
Formal Charge	0
Complexity	602
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