KDM2B-IN-1

CAT: 0607-BA4804-25Size: 25 mgDry Ice: NoHazardous: No

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CAT#:0607-BA4804-25Size:25 mg

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

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CAS Number

1965248-33-2

Form

A solid

Molecular Formula

C21H30N4O2S

Molecular Weight

402.55

Shipping Conditions

Blue ice

Storage Conditions

4°C, protect from light.

Chemical Information

Kdm2B-IN-1

CAS Number	1965248-33-2
PubChem CID	121477819
IUPAC Name	1-cyclobutyl-4-[1-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)-4,5-dihydroimidazol-2-yl]piperazine
Molecular Formula	C21H30N4O2S
Molecular Weight	402.6
XLogP	2.6
Topological Polar Surface Area	64.6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Heavy Atom Count	28
Formal Charge	0
Complexity	692

SMILES

C1CCC2=C(C1)C=CC(=C2)S(=O)(=O)N3CCN=C3N4CCN(CC4)C5CCC5

InChI

InChI=1S/C21H30N4O2S/c26-28(27,20-9-8-17-4-1-2-5-18(17)16-20)25-11-10-22-21(25)24-14-12-23(13-15-24)19-6-3-7-19/h8-9,16,19H,1-7,10-15H2

InChIKey

JPPPBGVARYKPJW-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1965248-33-2

CID: 121477819

Formula: C21H30N4O2S

MW: 402.6

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	402.6
XLogP3	2.6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Exact Mass	402.20894739
Monoisotopic Mass	402.20894739
Topological Polar Surface Area	64.6 Å²
Heavy Atom Count	28
Formal Charge	0
Complexity	692
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