C200-7309 Screening compound: methyl 3-{[3-(4-chlorobenzenesulfonyl)-6-fluoroquinolin-4-yl]sulfanyl}propanoate

C200-7309 Screening compound: methyl 3-{[3-(4-chlorobenzenesulfonyl)-6-fluoroquinolin-4-yl]sulfanyl}propanoate
C200-7309 Screening compound: methyl 3-{[3-(4-chlorobenzenesulfonyl)-6-fluoroquinolin-4-yl]sulfanyl}propanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound C200-7309
methyl 3-{[3-(4-chlorobenzenesulfonyl)-6-fluoroquinolin-4-yl]sulfanyl}propanoate

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

C200-7309

Molecular Formula

C19H15ClFNO4S2 (C19 H15 ClFNO4 S2)

Compound Name

methyl 3-{[3-(4-chlorobenzenesulfonyl)-6-fluoroquinolin-4-yl]sulfanyl}propanoate

IUPAC name

methyl 3-{[3-(4-chlorobenzenesulfonyl)-6-fluoroquinolin-4-yl]sulfanyl}propanoate

SMILES

COC(CCSc(c1cc(F)ccc1nc1)c1S(c(cc1)ccc1Cl)(=O)=O)=O

InChI

InChI=1S/C19H15ClFNO4S2/c1-26-18(23)8-9-27-19-15-10-13(21)4-7-16(15)22-11-17(19)28(24,25)14-5-2-12(20)3-6-14/h2-7,10-11H,8-9H2,1H3

InChI Key

DMIUYBVKSNVSGX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14728468

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

439.92

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.293

Distribution Coefficient, logD

4.293

Water Solubility, LogSw

-4.46

Polar Surface Area

59.171

Acid Dissociation Constant (pKa)

22.59

Base Dissociation Constant (pKb)

-0.90

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.80

C200-7309 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with C200-7309 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C200-7309?
Check Price and Availability of C200-7309, 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 C200-7309 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C200-7309
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C200-7309
  • 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 C200-7309 available by request