PD-85639

CAT: 0931-T70538-02Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0931-T70538-02Size:50 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

149838-21-1

Target

Others, Sodium Channel

Related Pathways

Others, Membrane transporter/Ion channel

Bioactivity

PD-85639 is a voltage-gated sodium (Na+) channel blocker (75% in 10 min & >95% in 25 min blockage of Na+ current by 25 μM PD85,639; whole-cell patch clamp using primary rat brain neurons) that is shown to target rat brain Nav1.2 with simultaneous high- and low-affinity modes of binding (EC50 = 56 nM/40% & 20 μM/60% at pH 9.0, 5 nM/28% & 3 μM/72% at pH 7.4, against 2 nM [3H]-PD85,639 for binding rat brain synaptosomes; EC50 = 17 nM/39% & 10 μM/61% using at pH 9.0 using rat brain synaptosome membranes) and a fast kinetic (t1/2 = 1.2 at 4°C, <0.5 min at 25°C), competitive against the local anesthetic Na+ channel blockers tetracaine, bupivacaine, and mepivacaine, as well as Na+ channel activators veratridine and batrachotoxin (K1 = 0.26 μM against 5 nM [3H]-BTX for binding rat neocrotical membranes) .

Smiles

C(C(NCCCN1C(C)CCCC1C)=O)(C2=CC=CC=C2)C3=CC=CC=C3

Molecular Formula

C24H32N2O

Molecular Weight

364.52

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

N-[3-(2,6-dimethylpiperidin-1-yl)propyl]-2,2-diphenylacetamide

See also: PD85639 (annotation moved to).

CAS Number	149838-21-1
PubChem CID	9950970
IUPAC Name	N-[3-(2,6-dimethylpiperidin-1-yl)propyl]-2,2-diphenylacetamide
Molecular Formula	C24H32N2O
Molecular Weight	364.5
XLogP	4.9
Topological Polar Surface Area	32.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	7
Heavy Atom Count	27
Formal Charge	0
Complexity	412

SMILES

CC1CCCC(N1CCCNC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3)C

InChI

InChI=1S/C24H32N2O/c1-19-11-9-12-20(2)26(19)18-10-17-25-24(27)23(21-13-5-3-6-14-21)22-15-7-4-8-16-22/h3-8,13-16,19-20,23H,9-12,17-18H2,1-2H3,(H,25,27)

InChIKey

BPZBEIHSHWNWTE-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 149838-21-1

CID: 9950970

Formula: C24H32N2O

MW: 364.5

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	364.5
XLogP3	4.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	7
Exact Mass	364.251463648
Monoisotopic Mass	364.251463648
Topological Polar Surface Area	32.3 Å²
Heavy Atom Count	27
Formal Charge	0
Complexity	412
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	2
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
ZFA83821-01	Pd-85639
HY-144649	PD-1/PD-L1-IN-24
HY-168078	PD-1/PD-L1-IN-50
HY-144447	PD-1/PD-L1-IN-17
HY-169190	PD-1/PD-L1-IN-53
HY-132202-01	PD-1/PD-L1-IN-10
HY-144442	PD-1/PD-L1-IN-15
HY-129172A	PD-1/PD-L1-IN 5
HY-145770	PD-1/PD-L1-IN-19
HY-179180	PD-1/PD-L1-IN-59

PD-85639

Chemical Information

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