5350-0369 Screening compound: ethyl 3-amino-2-(4-fluorobenzoyl)-4-[4-(methoxycarbonyl)phenyl]-6-methyl-4H,7H-thieno[2,3-b]pyridine-5-carboxylate

5350-0369 Screening compound: ethyl 3-amino-2-(4-fluorobenzoyl)-4-[4-(methoxycarbonyl)phenyl]-6-methyl-4H,7H-thieno[2,3-b]pyridine-5-carboxylate
5350-0369 Screening compound: ethyl 3-amino-2-(4-fluorobenzoyl)-4-[4-(methoxycarbonyl)phenyl]-6-methyl-4H,7H-thieno[2,3-b]pyridine-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 5350-0369
ethyl 3-amino-2-(4-fluorobenzoyl)-4-[4-(methoxycarbonyl)phenyl]-6-methyl-4H,7H-thieno[2,3-b]pyridine-5-carboxylate

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

5350-0369

Molecular Formula

C26H23FN2O5S (C26 H23 FN2 O5 S)

Compound Name

ethyl 3-amino-2-(4-fluorobenzoyl)-4-[4-(methoxycarbonyl)phenyl]-6-methyl-4H,7H-thieno[2,3-b]pyridine-5-carboxylate

IUPAC name

ethyl 3-amino-2-(4-fluorobenzoyl)-4-[4-(methoxycarbonyl)phenyl]-6-methyl-4H7H-thieno[23-b]pyridine-5-carboxylate

SMILES

CCOC(C(C1c(cc2)ccc2C(OC)=O)=C(C)Nc2c1c(N)c(C(c(cc1)ccc1F)=O)s2)=O

InChI

InChI=1S/C26H23FN2O5S/c1-4-34-26(32)18-13(2)29-24-20(19(18)14-5-7-16(8-6-14)25(31)33-3)21(28)23(35-24)22(30)15-9-11-17(27)12-10-15/h5-12,19,29H,4,28H2,1-3H3/t19-/m1/s1

InChI Key

OMLPQNRXOMEZOB-LJQANCHMSA-N

MDL Number (MFCD)

MFCD03270458

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

494.54

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.180

Distribution Coefficient, logD

5.022

Water Solubility, LogSw

-5.10

Polar Surface Area

85.386

Acid Dissociation Constant (pKa)

7.76

Base Dissociation Constant (pKb)

-3.49

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

19.20

5350-0369 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 5350-0369 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5350-0369?
Check Price and Availability of 5350-0369, 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 5350-0369 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5350-0369
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5350-0369
  • 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 5350-0369 available by request