G539-0128 Screening compound: methyl 4-({3-ethyl-2-methyl-7-phenyl-4H,5H,6H,7H-thieno[2,3-c]pyridine-6-carbonyl}amino)benzoate

G539-0128 Screening compound: methyl 4-({3-ethyl-2-methyl-7-phenyl-4H,5H,6H,7H-thieno[2,3-c]pyridine-6-carbonyl}amino)benzoate
G539-0128 Screening compound: methyl 4-({3-ethyl-2-methyl-7-phenyl-4H,5H,6H,7H-thieno[2,3-c]pyridine-6-carbonyl}amino)benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound G539-0128
methyl 4-({3-ethyl-2-methyl-7-phenyl-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

G539-0128

Molecular Formula

C25H26N2O3S (C25 H26 N2 O3 S)

Compound Name

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

IUPAC name

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

SMILES

CCc1c(C)sc(C2c3ccccc3)c1CCN2C(Nc(cc1)ccc1C(OC)=O)=O

InChI

InChI=1S/C25H26N2O3S/c1-4-20-16(2)31-23-21(20)14-15-27(22(23)17-8-6-5-7-9-17)25(29)26-19-12-10-18(11-13-19)24(28)30-3/h5-13,22H,4,14-15H2,1-3H3,(H,26,29)/t22-/m1/s1

InChI Key

YKSMAFAZBMFAMW-JOCHJYFZSA-N

MDL Number (MFCD)

MFCD15017384

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

434.56

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.488

Distribution Coefficient, logD

6.488

Water Solubility, LogSw

-5.81

Polar Surface Area

46.874

Acid Dissociation Constant (pKa)

12.64

Base Dissociation Constant (pKb)

-2.93

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

28.00

References: we are preparing a list of scientific research reports with G539-0128 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G539-0128?
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What is the minimum amount of G539-0128 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G539-0128
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G539-0128
  • 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 G539-0128 available by request