4466-1900 Screening compound: 8-(3-hydroxy-3-methylbutyl)-4,8-dimethoxy-5H,6H,7H,8H-furo[2,3-b]quinolin-7-ol

4466-1900 Screening compound: 8-(3-hydroxy-3-methylbutyl)-4,8-dimethoxy-5H,6H,7H,8H-furo[2,3-b]quinolin-7-ol
4466-1900 Screening compound: 8-(3-hydroxy-3-methylbutyl)-4,8-dimethoxy-5H,6H,7H,8H-furo[2,3-b]quinolin-7-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound 4466-1900
8-(3-hydroxy-3-methylbutyl)-4,8-dimethoxy-5H,6H,7H,8H-furo[2,3-b]quinolin-7-ol

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

4466-1900

Molecular Formula

C18H25NO5 (C18 H25 NO5)

Compound Name

8-(3-hydroxy-3-methylbutyl)-4,8-dimethoxy-5H,6H,7H,8H-furo[2,3-b]quinolin-7-ol

IUPAC name

8-(3-hydroxy-3-methylbutyl)-48-dimethoxy-5H6H7H8H-furo[23-b]quinolin-7-ol

SMILES

CC(C)(CCC(C(CC1)O)(c2c1c(OC)c(cco1)c1n2)OC)O

InChI

InChI=1S/C18H25NO5/c1-17(2,21)8-9-18(23-4)13(20)6-5-11-14(22-3)12-7-10-24-16(12)19-15(11)18/h7,10,13,20-21H,5-6,8-9H2,1-4H3

InChI Key

KHGNFPUMBJSZSM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00582426

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

335.4

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.390

Distribution Coefficient, logD

2.390

Water Solubility, LogSw

-2.40

Polar Surface Area

63.787

Acid Dissociation Constant (pKa)

14.69

Base Dissociation Constant (pKb)

3.57

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

61.10

4466-1900 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

3D-Pharmacophore Based Diversity Library (49813 compounds)

Akt-Targeted Library (14764 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

New Agro Library (44492 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 4466-1900 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4466-1900?
Check Price and Availability of 4466-1900, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 4466-1900 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4466-1900
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4466-1900
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 4466-1900 available by request