4896-4013 Screening compound: 7-{[(pyridin-2-yl)amino](2,4,6-trimethylphenyl)methyl}quinolin-8-ol

4896-4013 Screening compound: 7-{[(pyridin-2-yl)amino](2,4,6-trimethylphenyl)methyl}quinolin-8-ol
4896-4013 Screening compound: 7-{[(pyridin-2-yl)amino](2,4,6-trimethylphenyl)methyl}quinolin-8-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound 4896-4013
7-{[(pyridin-2-yl)amino](2,4,6-trimethylphenyl)methyl}quinolin-8-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

4896-4013

Molecular Formula

C24H23N3O (C24 H23 N3 O)

Compound Name

7-{[(pyridin-2-yl)amino](2,4,6-trimethylphenyl)methyl}quinolin-8-ol

IUPAC name

7-{[(pyridin-2-yl)amino](246-trimethylphenyl)methyl}quinolin-8-ol

SMILES

Cc1cc(C)c(C(c(ccc2cccnc22)c2O)Nc2ncccc2)c(C)c1

InChI

InChI=1S/C24H23N3O/c1-15-13-16(2)21(17(3)14-15)23(27-20-8-4-5-11-25-20)19-10-9-18-7-6-12-26-22(18)24(19)28/h4-14,23,28H,1-3H3,(H,25,27)/t23-/m0/s1

InChI Key

JEXROXHHDBQUAA-QHCPKHFHSA-N

MDL Number (MFCD)

MFCD02053709

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

369.47

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.857

Distribution Coefficient, logD

5.612

Water Solubility, LogSw

-5.96

Polar Surface Area

44.181

Acid Dissociation Constant (pKa)

10.20

Base Dissociation Constant (pKb)

7.28

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

16.70

4896-4013 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with 4896-4013 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4896-4013?
Check Price and Availability of 4896-4013, 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 4896-4013 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4896-4013
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4896-4013
  • 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 4896-4013 available by request