L987-0334 Screening compound: methyl 3-(2-{5-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-2-oxo-1,2-dihydropyridin-1-yl}acetamido)thiophene-2-carboxylate

L987-0334 Screening compound: methyl 3-(2-{5-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-2-oxo-1,2-dihydropyridin-1-yl}acetamido)thiophene-2-carboxylate
L987-0334 Screening compound: methyl 3-(2-{5-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-2-oxo-1,2-dihydropyridin-1-yl}acetamido)thiophene-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound L987-0334
methyl 3-(2-{5-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-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

L987-0334

Molecular Formula

C21H15ClN4O5S (C21 H15 ClN4 O5 S)

Compound Name

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

IUPAC name

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

SMILES

COC(c(scc1)c1NC(CN(C=C(C=C1)c2nc(-c(cc3)ccc3Cl)no2)C1=O)=O)=O

InChI

InChI=1S/C21H15ClN4O5S/c1-30-21(29)18-15(8-9-32-18)23-16(27)11-26-10-13(4-7-17(26)28)20-24-19(25-31-20)12-2-5-14(22)6-3-12/h2-10H,11H2,1H3,(H,23,27)

InChI Key

UYRRJAFVYKDEEB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27491235

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

470.89

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.289

Distribution Coefficient, logD

3.270

Water Solubility, LogSw

-3.87

Polar Surface Area

92.799

Acid Dissociation Constant (pKa)

8.74

Base Dissociation Constant (pKb)

-4.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.50

L987-0334 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

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

Protein Kinases Inhibitors Library (36801 compounds)

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with L987-0334 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L987-0334?
Check Price and Availability of L987-0334, 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 L987-0334 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L987-0334
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L987-0334
  • 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 L987-0334 available by request