PGP-4008

CAT: 0931-T28396-01Size: 2 mgDry Ice: NoHazardous: No

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CAT#:0931-T28396-01Size:2 mg

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

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CAS Number

365565-02-2

Target

P-gp

Related Pathways

Neuroscience, Membrane transporter/Ion channel

Purity

0.9895

Bioactivity

PGP-4008 is a selective and potent P-glycoprotein (Pgp) inhibitor that inhibits tumor growth by co-administration with Doxorubicin.

Smiles

O=C(Cc1ccccc1)Nc1c2CCN(Cc3ccccc3)c2nc2ccccc12

Molecular Formula

C26H23N3O

Molecular Weight

393.48

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

Pgp-4008

CAS Number	365565-02-2
PubChem CID	9821937
IUPAC Name	N-(1-benzyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-yl)-2-phenylacetamide
Molecular Formula	C26H23N3O
Molecular Weight	393.5
XLogP	4.9
Topological Polar Surface Area	45.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	5
Heavy Atom Count	30
Formal Charge	0
Complexity	569

SMILES

C1CN(C2=NC3=CC=CC=C3C(=C21)NC(=O)CC4=CC=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C26H23N3O/c30-24(17-19-9-3-1-4-10-19)28-25-21-13-7-8-14-23(21)27-26-22(25)15-16-29(26)18-20-11-5-2-6-12-20/h1-14H,15-18H2,(H,27,28,30)

InChIKey

HVIAKQBMYMKWII-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 365565-02-2

CID: 9821937

Formula: C26H23N3O

MW: 393.5

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	393.5
XLogP3	4.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	5
Exact Mass	393.184112366
Monoisotopic Mass	393.184112366
Topological Polar Surface Area	45.2 Å²
Heavy Atom Count	30
Formal Charge	0
Complexity	569
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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Catalog	Name
MBS565487-01	PGP-4008
BC-090	PGP-4008, P-GP Inhibitor Recombinant Protein
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PGP-4008

Chemical Information

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