G744-0403 Screening compound: methyl 3-(2-{3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-4,6-dimethyl-2-oxo-1,2-dihydropyridin-1-yl}acetamido)thiophene-2-carboxylate

G744-0403 Screening compound: methyl 3-(2-{3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-4,6-dimethyl-2-oxo-1,2-dihydropyridin-1-yl}acetamido)thiophene-2-carboxylate
G744-0403 Screening compound: methyl 3-(2-{3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-4,6-dimethyl-2-oxo-1,2-dihydropyridin-1-yl}acetamido)thiophene-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound G744-0403
methyl 3-(2-{3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-4,6-dimethyl-2-oxo-1,2-dihydropyridin-1-yl}acetamido)thiophene-2-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

G744-0403

Molecular Formula

C24H22N4O6S (C24 H22 N4 O6 S)

Compound Name

methyl 3-(2-{3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-4,6-dimethyl-2-oxo-1,2-dihydropyridin-1-yl}acetamido)thiophene-2-carboxylate

IUPAC name

methyl 3-(2-{3-[3-(4-methoxyphenyl)-124-oxadiazol-5-yl]-46-dimethyl-2-oxo-12-dihydropyridin-1-yl}acetamido)thiophene-2-carboxylate

SMILES

CC(C=C(C)N1CC(Nc2c(C(OC)=O)scc2)=O)=C(c2nc(-c(cc3)ccc3OC)no2)C1=O

InChI

InChI=1S/C24H22N4O6S/c1-13-11-14(2)28(12-18(29)25-17-9-10-35-20(17)24(31)33-4)23(30)19(13)22-26-21(27-34-22)15-5-7-16(32-3)8-6-15/h5-11H,12H2,1-4H3,(H,25,29)

InChI Key

KCVLNKOYSJEYFY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27155625

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

494.53

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

3.784

Distribution Coefficient, logD

3.755

Water Solubility, LogSw

-4.04

Polar Surface Area

99.020

Acid Dissociation Constant (pKa)

8.56

Base Dissociation Constant (pKb)

-3.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.80

G744-0403 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with G744-0403 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G744-0403?
Check Price and Availability of G744-0403, 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 G744-0403 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G744-0403
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G744-0403
  • 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 G744-0403 available by request