C066-4959 Screening compound: N-(4-fluorophenyl)-8-methyl-6-phenyl-4H,5H,6H-thieno[2,3-e]indazole-2-carboxamide

C066-4959 Screening compound: N-(4-fluorophenyl)-8-methyl-6-phenyl-4H,5H,6H-thieno[2,3-e]indazole-2-carboxamide
C066-4959 Screening compound: N-(4-fluorophenyl)-8-methyl-6-phenyl-4H,5H,6H-thieno[2,3-e]indazole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C066-4959
N-(4-fluorophenyl)-8-methyl-6-phenyl-4H,5H,6H-thieno[2,3-e]indazole-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

C066-4959

Molecular Formula

C23H18FN3OS (C23 H18 FN3 OS)

Compound Name

N-(4-fluorophenyl)-8-methyl-6-phenyl-4H,5H,6H-thieno[2,3-e]indazole-2-carboxamide

IUPAC name

N-(4-fluorophenyl)-8-methyl-6-phenyl-4H5H6H-thieno[23-e]indazole-2-carboxamide

SMILES

Cc(c-1c2CCc3c1sc(C(Nc(cc1)ccc1F)=O)c3)nn2-c1ccccc1

InChI

InChI=1S/C23H18FN3OS/c1-14-21-19(27(26-14)18-5-3-2-4-6-18)12-7-15-13-20(29-22(15)21)23(28)25-17-10-8-16(24)9-11-17/h2-6,8-11,13H,7,12H2,1H3,(H,25,28)

InChI Key

DETRNNAOJYXJFR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14716084

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

403.48

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.011

Distribution Coefficient, logD

5.011

Water Solubility, LogSw

-4.73

Polar Surface Area

38.400

Acid Dissociation Constant (pKa)

11.07

Base Dissociation Constant (pKb)

3.70

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.00

C066-4959 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with C066-4959 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C066-4959?
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What is the minimum amount of C066-4959 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C066-4959
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C066-4959
  • 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 C066-4959 available by request