E903-0744 Screening compound: methyl 3-(1-{[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}piperidine-4-amido)thiophene-2-carboxylate

E903-0744 Screening compound: methyl 3-(1-{[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}piperidine-4-amido)thiophene-2-carboxylate
E903-0744 Screening compound: methyl 3-(1-{[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}piperidine-4-amido)thiophene-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound E903-0744
methyl 3-(1-{[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}piperidine-4-amido)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

E903-0744

Molecular Formula

C23H26N4O6S (C23 H26 N4 O6 S)

Compound Name

methyl 3-(1-{[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}piperidine-4-amido)thiophene-2-carboxylate

IUPAC name

methyl 3-(1-{[3-(34-dimethoxyphenyl)-124-oxadiazol-5-yl]methyl}piperidine-4-amido)thiophene-2-carboxylate

SMILES

COC(c(scc1)c1NC(C1CCN(Cc2nc(-c(cc3)cc(OC)c3OC)no2)CC1)=O)=O

InChI

InChI=1S/C23H26N4O6S/c1-30-17-5-4-15(12-18(17)31-2)21-25-19(33-26-21)13-27-9-6-14(7-10-27)22(28)24-16-8-11-34-20(16)23(29)32-3/h4-5,8,11-12,14H,6-7,9-10,13H2,1-3H3,(H,24,28)

InChI Key

VCHRSUUWFMJWHY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14927014

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

486.55

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.829

Distribution Coefficient, logD

2.614

Water Solubility, LogSw

-3.29

Polar Surface Area

95.160

Acid Dissociation Constant (pKa)

7.84

Base Dissociation Constant (pKb)

6.70

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

39.10

E903-0744 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

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

Macl-GPIb alpha Interaction Library (22969 compounds)

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Hemic and lymphatic
  • Cardiovascular

References: we are preparing a list of scientific research reports with E903-0744 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E903-0744?
Check Price and Availability of E903-0744, 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 E903-0744 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E903-0744
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E903-0744
  • 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 E903-0744 available by request