C712-1174 Screening compound: N-(4-bromophenyl)-N-methyl-4H-thieno[3,2-c]chromene-2-carboxamide

C712-1174 Screening compound: N-(4-bromophenyl)-N-methyl-4H-thieno[3,2-c]chromene-2-carboxamide
C712-1174 Screening compound: N-(4-bromophenyl)-N-methyl-4H-thieno[3,2-c]chromene-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C712-1174
N-(4-bromophenyl)-N-methyl-4H-thieno[3,2-c]chromene-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

C712-1174

Molecular Formula

C19H14BrNO2S (C19 H14 BrNO2 S)

Compound Name

N-(4-bromophenyl)-N-methyl-4H-thieno[3,2-c]chromene-2-carboxamide

IUPAC name

N-(4-bromophenyl)-N-methyl-4H-thieno[32-c]chromene-2-carboxamide

SMILES

CN(C(c1cc(COc2c-3cccc2)c3s1)=O)c(cc1)ccc1Br

InChI

InChI=1S/C19H14BrNO2S/c1-21(14-8-6-13(20)7-9-14)19(22)17-10-12-11-23-16-5-3-2-4-15(16)18(12)24-17/h2-10H,11H2,1H3

InChI Key

JHQRDQHZABELRZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14787258

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

400.3

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.838

Distribution Coefficient, logD

4.838

Water Solubility, LogSw

-4.65

Polar Surface Area

24.724

Acid Dissociation Constant (pKa)

25.02

Base Dissociation Constant (pKb)

-3.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.50

C712-1174 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Human Kinases Annotated Library (2415 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with C712-1174 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C712-1174?
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What is the minimum amount of C712-1174 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C712-1174
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C712-1174
  • 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 C712-1174 available by request