C301-6883 Screening compound: 3-chloro-N-[2-oxo-4-(propylamino)-2H-chromen-3-yl]-1-benzothiophene-2-carboxamide

C301-6883 Screening compound: 3-chloro-N-[2-oxo-4-(propylamino)-2H-chromen-3-yl]-1-benzothiophene-2-carboxamide
C301-6883 Screening compound: 3-chloro-N-[2-oxo-4-(propylamino)-2H-chromen-3-yl]-1-benzothiophene-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C301-6883
3-chloro-N-[2-oxo-4-(propylamino)-2H-chromen-3-yl]-1-benzothiophene-2-carboxamide

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

C301-6883

Molecular Formula

C21H17ClN2O3S (C21 H17 ClN2 O3 S)

Compound Name

3-chloro-N-[2-oxo-4-(propylamino)-2H-chromen-3-yl]-1-benzothiophene-2-carboxamide

IUPAC name

3-chloro-N-[2-oxo-4-(propylamino)-2H-chromen-3-yl]-1-benzothiophene-2-carboxamide

SMILES

CCCNC(c(cccc1)c1OC1=O)=C1NC(c(sc1c2cccc1)c2Cl)=O

InChI

InChI=1S/C21H17ClN2O3S/c1-2-11-23-17-12-7-3-5-9-14(12)27-21(26)18(17)24-20(25)19-16(22)13-8-4-6-10-15(13)28-19/h3-10,23H,2,11H2,1H3,(H,24,25)

InChI Key

SWMIUAQJNGHDQS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09696327

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

412.9

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.427

Distribution Coefficient, logD

3.746

Water Solubility, LogSw

-4.76

Polar Surface Area

55.744

Acid Dissociation Constant (pKa)

6.82

Base Dissociation Constant (pKb)

-3.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

C301-6883 in Drug Discovery

Included in Screening Libraries

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with C301-6883 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C301-6883?
Check Price and Availability of C301-6883, 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 C301-6883 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C301-6883
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C301-6883
  • 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 C301-6883 available by request