C301-2553 Screening compound: N-[2-(3,4-diethoxyphenyl)ethyl]-5-[(3,4,5-trimethoxyphenyl)methyl]-1,3,4-oxadiazole-2-carboxamide

C301-2553 Screening compound: N-[2-(3,4-diethoxyphenyl)ethyl]-5-[(3,4,5-trimethoxyphenyl)methyl]-1,3,4-oxadiazole-2-carboxamide
C301-2553 Screening compound: N-[2-(3,4-diethoxyphenyl)ethyl]-5-[(3,4,5-trimethoxyphenyl)methyl]-1,3,4-oxadiazole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C301-2553
N-[2-(3,4-diethoxyphenyl)ethyl]-5-[(3,4,5-trimethoxyphenyl)methyl]-1,3,4-oxadiazole-2-carboxamide

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

C301-2553

Molecular Formula

C25H31N3O7 (C25 H31 N3 O7)

Compound Name

N-[2-(3,4-diethoxyphenyl)ethyl]-5-[(3,4,5-trimethoxyphenyl)methyl]-1,3,4-oxadiazole-2-carboxamide

IUPAC name

N-[2-(34-diethoxyphenyl)ethyl]-5-[(345-trimethoxyphenyl)methyl]-134-oxadiazole-2-carboxamide

SMILES

CCOc(ccc(CCNC(c1nnc(Cc(cc2OC)cc(OC)c2OC)o1)=O)c1)c1OCC

InChI

InChI=1S/C25H31N3O7/c1-6-33-18-9-8-16(12-19(18)34-7-2)10-11-26-24(29)25-28-27-22(35-25)15-17-13-20(30-3)23(32-5)21(14-17)31-4/h8-9,12-14H,6-7,10-11,15H2,1-5H3,(H,26,29)

InChI Key

ZSMZYUWTXVSIBV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14742636

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

485.54

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

14.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

1.926

Distribution Coefficient, logD

1.926

Water Solubility, LogSw

-2.74

Polar Surface Area

92.073

Acid Dissociation Constant (pKa)

13.07

Base Dissociation Constant (pKb)

-2.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

C301-2553 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C301-2553 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C301-2553?
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What is the minimum amount of C301-2553 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C301-2553
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C301-2553
  • 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 C301-2553 available by request