Products for Research Use Only
RegisterLogin

Alvelestat 100mg

CAT: 0628-A12779-100Size: 100 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0628-A12779-100Size:100 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
848141-11-7

Chemical Information

Alvelestat

Alvelestat has been investigated for the basic science of Chronic Obstructive Pulmonary Disease.

CAS Number848141-11-7
PubChem CID46861623
IUPAC Name6-methyl-5-(2-methylpyrazol-3-yl)-N-[(5-methylsulfonyl-2-pyridinyl)methyl]-2-oxo-1-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide
Molecular FormulaC25H22F3N5O4S
Molecular Weight545.5
XLogP2.5
Topological Polar Surface Area123
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count9
Rotatable Bond Count6
Heavy Atom Count38
Formal Charge0
Complexity1100
SMILES
CC1=C(C=C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)C(=O)NCC3=NC=C(C=C3)S(=O)(=O)C)C4=CC=NN4C
InChI
InChI=1S/C25H22F3N5O4S/c1-15-20(22-9-10-31-32(22)2)12-21(23(34)30-13-17-7-8-19(14-29-17)38(3,36)37)24(35)33(15)18-6-4-5-16(11-18)25(26,27)28/h4-12,14H,13H2,1-3H3,(H,30,34)
InChIKey
QNQZWEGMKJBHEM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Alvelestat
CAS: 848141-11-7
CID: 46861623
Formula: C25H22F3N5O4S
MW: 545.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight545.5
XLogP32.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count9
Rotatable Bond Count6
Exact Mass545.13445986
Monoisotopic Mass545.13445986
Topological Polar Surface Area123 Ų
Heavy Atom Count38
Formal Charge0
Complexity1100
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
A12779-10Alvelestat 10mg
A12779-1Alvelestat 1mg
A12779-25Alvelestat 25mg
A12779-50Alvelestat 50mg
A12779-5Alvelestat 5mg
A12779-500Alvelestat 500mg
A12779-2Alvelestat 2mg
A12779-10mM-DAlvelestat 10mM * 1mL in DMSO
A20941-100LEQ506 100mg
A16059-100DTP3 100mg

Alternative Products

CatalogName
B1653-25Alvelestat
S7218-5mgAlvelestat (AZD9668)
HY-15651AAlvelestat (tosylate)
T3107L-01Alvelestat tosylate
510254Alvelestat (AZD9688)
HY-15651R-01Alvelestat (Standard)

Popular Products