Avosentan (SPP301) 1mg

CAT: 0628-A11301-1Size: 1 mgDry Ice: NoHazardous: No

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CAT#:0628-A11301-1Size:1 mg

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CAS Number

290815-26-8

Chemical Information

Avosentan

SPP301 (Avosentan) is a potent and highly selective ET[A] receptor blocker and is clinically investigated in diabetic nephropathy. This study was designed to evaluate whether avosentan influences the pharmacokinetics of steroid oral contraceptives.

CAS Number	290815-26-8
PubChem CID	9912992
IUPAC Name	N-[6-methoxy-5-(2-methoxyphenoxy)-2-pyridin-4-ylpyrimidin-4-yl]-5-methylpyridine-2-sulfonamide
Molecular Formula	C23H21N5O5S
Molecular Weight	479.5
XLogP	3.1
Topological Polar Surface Area	134
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	10
Rotatable Bond Count	8
Heavy Atom Count	34
Formal Charge	0
Complexity	732

SMILES

CC1=CN=C(C=C1)S(=O)(=O)NC2=C(C(=NC(=N2)C3=CC=NC=C3)OC)OC4=CC=CC=C4OC

InChI

InChI=1S/C23H21N5O5S/c1-15-8-9-19(25-14-15)34(29,30)28-22-20(33-18-7-5-4-6-17(18)31-2)23(32-3)27-21(26-22)16-10-12-24-13-11-16/h4-14H,1-3H3,(H,26,27,28)

InChIKey

YBWLTKFZAOSWSM-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 290815-26-8

CID: 9912992

Formula: C23H21N5O5S

MW: 479.5

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	479.5
XLogP3	3.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	10
Rotatable Bond Count	8
Exact Mass	479.12633996
Monoisotopic Mass	479.12633996
Topological Polar Surface Area	134 Å²
Heavy Atom Count	34
Formal Charge	0
Complexity	732
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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Alternative Products

Catalog	Name
MBS386692-01	Avosentan (SPP301)
QLA81526-01	Avosentan
HY-15195R-01	Avosentan (Standard)
TRC-A794712-25MG	Avosentan-d3

Avosentan (SPP301) 1mg

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