G539-1037 Screening compound: ethyl 2-{[3-ethyl-7-(4-fluorophenyl)-2-methyl-4H,5H,6H,7H-thieno[2,3-c]pyridine-6-carbonyl]amino}benzoate

G539-1037 Screening compound: ethyl 2-{[3-ethyl-7-(4-fluorophenyl)-2-methyl-4H,5H,6H,7H-thieno[2,3-c]pyridine-6-carbonyl]amino}benzoate
G539-1037 Screening compound: ethyl 2-{[3-ethyl-7-(4-fluorophenyl)-2-methyl-4H,5H,6H,7H-thieno[2,3-c]pyridine-6-carbonyl]amino}benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound G539-1037
ethyl 2-{[3-ethyl-7-(4-fluorophenyl)-2-methyl-4H,5H,6H,7H-thieno[2,3-c]pyridine-6-carbonyl]amino}benzoate

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

G539-1037

Molecular Formula

C26H27FN2O3S (C26 H27 FN2 O3 S)

Compound Name

ethyl 2-{[3-ethyl-7-(4-fluorophenyl)-2-methyl-4H,5H,6H,7H-thieno[2,3-c]pyridine-6-carbonyl]amino}benzoate

IUPAC name

ethyl 2-{[3-ethyl-7-(4-fluorophenyl)-2-methyl-4H5H6H7H-thieno[23-c]pyridine-6-carbonyl]amino}benzoate

SMILES

CCc1c(C)sc(C2c(cc3)ccc3F)c1CCN2C(Nc(cccc1)c1C(OCC)=O)=O

InChI

InChI=1S/C26H27FN2O3S/c1-4-19-16(3)33-24-20(19)14-15-29(23(24)17-10-12-18(27)13-11-17)26(31)28-22-9-7-6-8-21(22)25(30)32-5-2/h6-13,23H,4-5,14-15H2,1-3H3,(H,28,31)/t23-/m1/s1

InChI Key

YAFGOLLEFHAVCQ-HSZRJFAPSA-N

MDL Number (MFCD)

MFCD15017462

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

466.58

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

7.086

Distribution Coefficient, logD

7.086

Water Solubility, LogSw

-5.77

Polar Surface Area

45.756

Acid Dissociation Constant (pKa)

10.43

Base Dissociation Constant (pKb)

-3.61

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

30.80

References: we are preparing a list of scientific research reports with G539-1037 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G539-1037?
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What is the minimum amount of G539-1037 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G539-1037
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G539-1037
  • 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 G539-1037 available by request