1254-0267 Screening compound: (2E)-1-(6-chloro-2-methyl-4-phenylquinolin-3-yl)-3-(3,4-dimethoxyphenyl)prop-2-en-1-one

1254-0267 Screening compound: (2E)-1-(6-chloro-2-methyl-4-phenylquinolin-3-yl)-3-(3,4-dimethoxyphenyl)prop-2-en-1-one
1254-0267 Screening compound: (2E)-1-(6-chloro-2-methyl-4-phenylquinolin-3-yl)-3-(3,4-dimethoxyphenyl)prop-2-en-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 1254-0267
(2E)-1-(6-chloro-2-methyl-4-phenylquinolin-3-yl)-3-(3,4-dimethoxyphenyl)prop-2-en-1-one

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

1254-0267

Molecular Formula

C27H22ClNO3 (C27 H22 ClNO3)

Compound Name

(2E)-1-(6-chloro-2-methyl-4-phenylquinolin-3-yl)-3-(3,4-dimethoxyphenyl)prop-2-en-1-one

IUPAC name

(2E)-1-(6-chloro-2-methyl-4-phenylquinolin-3-yl)-3-(34-dimethoxyphenyl)prop-2-en-1-one

SMILES

Cc1c(C(/C=C/c(cc2)cc(OC)c2OC)=O)c(-c2ccccc2)c(cc(cc2)Cl)c2n1

InChI

InChI=1S/C27H22ClNO3/c1-17-26(23(30)13-9-18-10-14-24(31-2)25(15-18)32-3)27(19-7-5-4-6-8-19)21-16-20(28)11-12-22(21)29-17/h4-16H,1-3H3

InChI Key

GCYFXVGPAAVVBB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00630855

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

443.93

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.690

Distribution Coefficient, logD

6.690

Water Solubility, LogSw

-6.50

Polar Surface Area

37.111

Acid Dissociation Constant (pKa)

27.99

Base Dissociation Constant (pKb)

-0.86

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

1254-0267 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Frequent Hitters Library (7624 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Structure:
  • Pool

References: we are preparing a list of scientific research reports with 1254-0267 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1254-0267?
Check Price and Availability of 1254-0267, 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 1254-0267 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1254-0267
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1254-0267
  • 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 1254-0267 available by request