CDK9-IN-10

CAT: 0607-BA3838-25Size: 25 mgDry Ice: NoHazardous: No

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CAT#:0607-BA3838-25Size:25 mg

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

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CAS Number

3542-63-0

Form

A solid

Molecular Formula

C22H16O5

Molecular Weight

360.36

Shipping Conditions

Blue ice

Storage Conditions

4°C, desiccated and protect from light.

Chemical Information

Cdk9-IN-10

CAS Number	3542-63-0
PubChem CID	15108688
IUPAC Name	5,8-dihydroxy-2-phenyl-7-phenylmethoxychromen-4-one
Molecular Formula	C22H16O5
Molecular Weight	360.4
XLogP	4.5
Topological Polar Surface Area	76
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	4
Heavy Atom Count	27
Formal Charge	0
Complexity	547

SMILES

C1=CC=C(C=C1)COC2=C(C3=C(C(=C2)O)C(=O)C=C(O3)C4=CC=CC=C4)O

InChI

InChI=1S/C22H16O5/c23-16-11-18(15-9-5-2-6-10-15)27-22-20(16)17(24)12-19(21(22)25)26-13-14-7-3-1-4-8-14/h1-12,24-25H,13H2

InChIKey

OQHAZMRRNANBMN-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 3542-63-0

CID: 15108688

Formula: C22H16O5

MW: 360.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	360.4
XLogP3	4.5
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	4
Exact Mass	360.09977361
Monoisotopic Mass	360.09977361
Topological Polar Surface Area	76 Å²
Heavy Atom Count	27
Formal Charge	0
Complexity	547
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

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