C301-9735 Screening compound: 3-(3-chloro-4-fluorophenyl)-1-(2-{[(3-methylquinoxalin-2-yl)methyl]sulfanyl}phenyl)urea

C301-9735 Screening compound: 3-(3-chloro-4-fluorophenyl)-1-(2-{[(3-methylquinoxalin-2-yl)methyl]sulfanyl}phenyl)urea
C301-9735 Screening compound: 3-(3-chloro-4-fluorophenyl)-1-(2-{[(3-methylquinoxalin-2-yl)methyl]sulfanyl}phenyl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound C301-9735
3-(3-chloro-4-fluorophenyl)-1-(2-{[(3-methylquinoxalin-2-yl)methyl]sulfanyl}phenyl)urea

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

C301-9735

Molecular Formula

C23H18ClFN4OS (C23 H18 ClFN4 OS)

Compound Name

3-(3-chloro-4-fluorophenyl)-1-(2-{[(3-methylquinoxalin-2-yl)methyl]sulfanyl}phenyl)urea

IUPAC name

3-(3-chloro-4-fluorophenyl)-1-(2-{[(3-methylquinoxalin-2-yl)methyl]sulfanyl}phenyl)urea

SMILES

Cc1nc2ccccc2nc1CSc(cccc1)c1NC(Nc(cc1)cc(Cl)c1F)=O

InChI

InChI=1S/C23H18ClFN4OS/c1-14-21(28-19-7-3-2-6-18(19)26-14)13-31-22-9-5-4-8-20(22)29-23(30)27-15-10-11-17(25)16(24)12-15/h2-12H,13H2,1H3,(H2,27,29,30)

InChI Key

FHOXYXWNOAYQLP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14746101

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

452.94

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.009

Distribution Coefficient, logD

6.009

Water Solubility, LogSw

-6.04

Polar Surface Area

50.348

Acid Dissociation Constant (pKa)

10.55

Base Dissociation Constant (pKb)

4.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.70

C301-9735 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Anticancer Library (62698 compounds)

Antifungal Library (16415 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with C301-9735 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C301-9735?
Check Price and Availability of C301-9735, 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 C301-9735 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C301-9735
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C301-9735
  • 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 C301-9735 available by request