BIIL-260 hydrochloride

CAT: 0127-BUP14091-01Size: 5 mgDry Ice: NoHazardous: No

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CAT#:0127-BUP14091-01Size:5 mg

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CAS Number

192581-24-1

Purity

=98%

Smiles

Cl.CC(C)(c1ccc(O)cc1)c1ccc(OCc2cccc(COc3ccc(cc3)C(N)=N)c2)cc1

Chemical Information

BIIL-260 (hydrochloride)

CAS Number	192581-24-1
PubChem CID	23292598
IUPAC Name	4-[[3-[[4-[2-(4-hydroxyphenyl)propan-2-yl]phenoxy]methyl]phenyl]methoxy]benzenecarboximidamide;hydrochloride
Molecular Formula	C30H31ClN2O3
Molecular Weight	503.0
Topological Polar Surface Area	88.6
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	9
Heavy Atom Count	36
Formal Charge	0
Complexity	644

SMILES

CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)OCC3=CC=CC(=C3)COC4=CC=C(C=C4)C(=N)N.Cl

InChI

InChI=1S/C30H30N2O3.ClH/c1-30(2,24-8-12-26(33)13-9-24)25-10-16-28(17-11-25)35-20-22-5-3-4-21(18-22)19-34-27-14-6-23(7-15-27)29(31)32;/h3-18,33H,19-20H2,1-2H3,(H3,31,32);1H

InChIKey

KYFHIWXKXUSXKB-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 192581-24-1

CID: 23292598

Formula: C30H31ClN2O3

MW: 503.0

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	503.0
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	9
Exact Mass	502.2023205
Monoisotopic Mass	502.2023205
Topological Polar Surface Area	88.6 Å²
Heavy Atom Count	36
Formal Charge	0
Complexity	644
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	2
Compound Is Canonicalized	Yes

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Alternative Products

Catalog	Name
HY-114641A-01	BIIL-260 (hydrochloride)
MBS3846212-01	BIIL-260 hydrochloride
A21788-100	BIIL-260 hydrochloride 100mg
A21788-10	BIIL-260 hydrochloride 10mg
A21788-50	BIIL-260 hydrochloride 50mg
A21788-25	BIIL-260 hydrochloride 25mg
A21788-1	BIIL-260 hydrochloride 1mg
A21788-200	BIIL-260 hydrochloride 200mg
A21788-5	BIIL-260 hydrochloride 5mg
A21788-10mM-D	BIIL-260 hydrochloride 10mM * 1mL in DMSO

BIIL-260 hydrochloride

Chemical Information

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