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LY285434

CAT: 0931-T11910-03Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0931-T11910-03Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
159748-08-0
Target
RAAS, Others
Related Pathways
Endocrinology/Hormones, Others
Bioactivity
LY285434 is an angiotensin II receptor antagonist [suitable].
Smiles
C(CCCCCC)(C(O)=O)N1C=2C(=CC(=CC2)C3=C(C=CC=C3)C=4NN=NN4)C=C1
Molecular Formula
C23H25N5O2
Molecular Weight
403.48
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

2-[5-[2-(2H-tetrazol-5-yl)phenyl]indol-1-yl]octanoic Acid
CAS Number159748-08-0
PubChem CID9909147
IUPAC Name2-[5-[2-(2H-tetrazol-5-yl)phenyl]indol-1-yl]octanoic acid
Molecular FormulaC23H25N5O2
Molecular Weight403.5
XLogP5.4
Topological Polar Surface Area96.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count9
Heavy Atom Count30
Formal Charge0
Complexity562
SMILES
CCCCCCC(C(=O)O)N1C=CC2=C1C=CC(=C2)C3=CC=CC=C3C4=NNN=N4
InChI
InChI=1S/C23H25N5O2/c1-2-3-4-5-10-21(23(29)30)28-14-13-17-15-16(11-12-20(17)28)18-8-6-7-9-19(18)22-24-26-27-25-22/h6-9,11-15,21H,2-5,10H2,1H3,(H,29,30)(H,24,25,26,27)
InChIKey
FCWWQZQDBUMEJF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-[5-[2-(2H-tetrazol-5-yl)phenyl]indol-1-yl]octanoic Acid
CAS: 159748-08-0
CID: 9909147
Formula: C23H25N5O2
MW: 403.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight403.5
XLogP35.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count9
Exact Mass403.20082506
Monoisotopic Mass403.20082506
Topological Polar Surface Area96.7 Ų
Heavy Atom Count30
Formal Charge0
Complexity562
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
MBS5767018LY285434

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