3777-0741 Screening compound: N-{4-[2-(4-chloro-3,5-dimethylphenoxy)acetamido]-2-methoxyphenyl}furan-2-carboxamide

3777-0741 Screening compound: N-{4-[2-(4-chloro-3,5-dimethylphenoxy)acetamido]-2-methoxyphenyl}furan-2-carboxamide
3777-0741 Screening compound: N-{4-[2-(4-chloro-3,5-dimethylphenoxy)acetamido]-2-methoxyphenyl}furan-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3777-0741
N-{4-[2-(4-chloro-3,5-dimethylphenoxy)acetamido]-2-methoxyphenyl}furan-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

3777-0741

Molecular Formula

C22H21ClN2O5 (C22 H21 ClN2 O5)

Compound Name

N-{4-[2-(4-chloro-3,5-dimethylphenoxy)acetamido]-2-methoxyphenyl}furan-2-carboxamide

IUPAC name

N-{4-[2-(4-chloro-35-dimethylphenoxy)acetamido]-2-methoxyphenyl}furan-2-carboxamide

SMILES

Cc1cc(OCC(Nc(cc2)cc(OC)c2NC(c2ccco2)=O)=O)cc(C)c1Cl

InChI

InChI=1S/C22H21ClN2O5/c1-13-9-16(10-14(2)21(13)23)30-12-20(26)24-15-6-7-17(19(11-15)28-3)25-22(27)18-5-4-8-29-18/h4-11H,12H2,1-3H3,(H,24,26)(H,25,27)

InChI Key

JLDUPLMYGRHKPC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02805071

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

428.87

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.849

Distribution Coefficient, logD

4.848

Water Solubility, LogSw

-4.94

Polar Surface Area

69.218

Acid Dissociation Constant (pKa)

10.10

Base Dissociation Constant (pKb)

1.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

3777-0741 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with 3777-0741 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3777-0741?
Check Price and Availability of 3777-0741, 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 3777-0741 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3777-0741
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3777-0741
  • 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 3777-0741 available by request