C908-0084 Screening compound: methyl 3-(2,6-difluorobenzamido)-5-phenylthiophene-2-carboxylate

C908-0084 Screening compound: methyl 3-(2,6-difluorobenzamido)-5-phenylthiophene-2-carboxylate
C908-0084 Screening compound: methyl 3-(2,6-difluorobenzamido)-5-phenylthiophene-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound C908-0084
methyl 3-(2,6-difluorobenzamido)-5-phenylthiophene-2-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

C908-0084

Molecular Formula

C19H13F2NO3S (C19 H13 F2 NO3 S)

Compound Name

methyl 3-(2,6-difluorobenzamido)-5-phenylthiophene-2-carboxylate

IUPAC name

methyl 3-(26-difluorobenzamido)-5-phenylthiophene-2-carboxylate

SMILES

COC(c(sc(-c1ccccc1)c1)c1NC(c(c(F)ccc1)c1F)=O)=O

InChI

InChI=1S/C19H13F2NO3S/c1-25-19(24)17-14(10-15(26-17)11-6-3-2-4-7-11)22-18(23)16-12(20)8-5-9-13(16)21/h2-10H,1H3,(H,22,23)

InChI Key

CGCPTHNXNJOAMG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04418054

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

373.38

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.787

Distribution Coefficient, logD

3.924

Water Solubility, LogSw

-4.82

Polar Surface Area

44.552

Acid Dissociation Constant (pKa)

6.60

Base Dissociation Constant (pKb)

-8.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.30

C908-0084 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Anticancer Library (62698 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Cancer
Targets:
  • Kinases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with C908-0084 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C908-0084?
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What is the minimum amount of C908-0084 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C908-0084
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C908-0084
  • 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 C908-0084 available by request