1607-0158 Screening compound: N-{2-[(1E)-2-(8-hydroxy-5-methylquinolin-2-yl)ethenyl]phenyl}acetamide

1607-0158 Screening compound: N-{2-[(1E)-2-(8-hydroxy-5-methylquinolin-2-yl)ethenyl]phenyl}acetamide
1607-0158 Screening compound: N-{2-[(1E)-2-(8-hydroxy-5-methylquinolin-2-yl)ethenyl]phenyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1607-0158
N-{2-[(1E)-2-(8-hydroxy-5-methylquinolin-2-yl)ethenyl]phenyl}acetamide

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

1607-0158

Molecular Formula

C20H18N2O2 (C20 H18 N2 O2)

Compound Name

N-{2-[(1E)-2-(8-hydroxy-5-methylquinolin-2-yl)ethenyl]phenyl}acetamide

IUPAC name

N-{2-[(1E)-2-(8-hydroxy-5-methylquinolin-2-yl)ethenyl]phenyl}acetamide

SMILES

CC(Nc1c(/C=C/c(ccc2c(C)cc3)nc2c3O)cccc1)=O

InChI

InChI=1S/C20H18N2O2/c1-13-7-12-19(24)20-17(13)11-10-16(22-20)9-8-15-5-3-4-6-18(15)21-14(2)23/h3-12,24H,1-2H3,(H,21,23)

InChI Key

UDPDZUOFMXSVGK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01308909

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

318.38

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.829

Distribution Coefficient, logD

3.821

Water Solubility, LogSw

-3.76

Polar Surface Area

48.676

Acid Dissociation Constant (pKa)

10.40

Base Dissociation Constant (pKb)

5.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

1607-0158 in Drug Discovery

Included in Screening Libraries

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

Frequent Hitters Library (7624 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 1607-0158 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1607-0158?
Check Price and Availability of 1607-0158, 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 1607-0158 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1607-0158
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1607-0158
  • 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 1607-0158 available by request