C201-0319 Screening compound: methyl 4-[(2-chloro-6-fluorophenyl)methoxy]-2-{[(2-chlorophenyl)methyl]sulfanyl}quinoline-3-carboxylate

C201-0319 Screening compound: methyl 4-[(2-chloro-6-fluorophenyl)methoxy]-2-{[(2-chlorophenyl)methyl]sulfanyl}quinoline-3-carboxylate
C201-0319 Screening compound: methyl 4-[(2-chloro-6-fluorophenyl)methoxy]-2-{[(2-chlorophenyl)methyl]sulfanyl}quinoline-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound C201-0319
methyl 4-[(2-chloro-6-fluorophenyl)methoxy]-2-{[(2-chlorophenyl)methyl]sulfanyl}quinoline-3-carboxylate

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

C201-0319

Molecular Formula

C25H18Cl2FNO3S (C25 H18 Cl2 FNO3 S)

Compound Name

methyl 4-[(2-chloro-6-fluorophenyl)methoxy]-2-{[(2-chlorophenyl)methyl]sulfanyl}quinoline-3-carboxylate

IUPAC name

methyl 4-[(2-chloro-6-fluorophenyl)methoxy]-2-{[(2-chlorophenyl)methyl]sulfanyl}quinoline-3-carboxylate

SMILES

COC(c(c(SCc(cccc1)c1Cl)nc1ccccc11)c1OCc(c(F)ccc1)c1Cl)=O

InChI

InChI=1S/C25H18Cl2FNO3S/c1-31-25(30)22-23(32-13-17-19(27)10-6-11-20(17)28)16-8-3-5-12-21(16)29-24(22)33-14-15-7-2-4-9-18(15)26/h2-12H,13-14H2,1H3

InChI Key

VIRLIQGIGLAHKF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14729342

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

502.39

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

7.476

Distribution Coefficient, logD

7.476

Water Solubility, LogSw

-6.58

Polar Surface Area

37.004

Acid Dissociation Constant (pKa)

25.77

Base Dissociation Constant (pKb)

-0.31

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.00

C201-0319 in Drug Discovery

Included in Screening Libraries

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C201-0319 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C201-0319?
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What is the minimum amount of C201-0319 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C201-0319
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C201-0319
  • 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 C201-0319 available by request