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I-APT

CAT: 0931-T202840-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-T202840-02Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
126632-01-7
Bioactivity
Iodoaminopotentidine (I-APT) is an exceptionally potent H2 receptor antagonist.
Smiles
N#CNC(=NCCCOC1=CC=CC(=C1)CN2CCCCC2)NCCNC(=O)C3=CC=C(N)C(I)=C3
Molecular Formula
C26H34IN7O2
Molecular Weight
603.5
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Iodoaminopotentidine

histamine H2 receptor antagonist; structure given in first source

CAS Number126632-01-7
PubChem CID181461
IUPAC Name4-amino-N-[2-[[N-cyano-N'-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]carbamimidoyl]amino]ethyl]-3-iodobenzamide
Molecular FormulaC26H34IN7O2
Molecular Weight603.5
XLogP3.2
Topological Polar Surface Area128
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count13
Heavy Atom Count36
Formal Charge0
Complexity737
SMILES
C1CCN(CC1)CC2=CC(=CC=C2)OCCCN=C(NCCNC(=O)C3=CC(=C(C=C3)N)I)NC#N
InChI
InChI=1S/C26H34IN7O2/c27-23-17-21(8-9-24(23)29)25(35)30-11-12-32-26(33-19-28)31-10-5-15-36-22-7-4-6-20(16-22)18-34-13-2-1-3-14-34/h4,6-9,16-17H,1-3,5,10-15,18,29H2,(H,30,35)(H2,31,32,33)
InChIKey
VJTYCMQYDRXNNY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Iodoaminopotentidine
CAS: 126632-01-7
CID: 181461
Formula: C26H34IN7O2
MW: 603.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight603.5
XLogP33.2
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count13
Exact Mass603.18187
Monoisotopic Mass603.18187
Topological Polar Surface Area128 Ų
Heavy Atom Count36
Formal Charge0
Complexity737
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

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Alternative Products

CatalogName
GTR19241690-01I-APT
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MBS6425078-01LYPLA1 (Lysophospholipase I, APT1, LPL1, APT-1, LPL-I, hAPT1) (APC)
MBS6425087-01LYPLA1 (Lysophospholipase I, APT1, LPL1, APT-1, LPL-I, hAPT1) (PE)
MBS6425081-01LYPLA1 (Lysophospholipase I, APT1, LPL1, APT-1, LPL-I, hAPT1) (HRP)
MBS6425080-01LYPLA1 (Lysophospholipase I, APT1, LPL1, APT-1, LPL-I, hAPT1) (FITC)
MBS6425077-01LYPLA1 (Lysophospholipase I, APT1, LPL1, APT-1, LPL-I, hAPT1) (AP)
MBS6425079-01LYPLA1 (Lysophospholipase I, APT1, LPL1, APT-1, LPL-I, hAPT1) (Biotin)
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LA5650APT Agar

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