2871-3872 Screening compound: (2Z)-N-(2-bromo-4-methylphenyl)-2-[(3,4-dimethoxyphenyl)formamido]-3-(2-methoxyphenyl)prop-2-enamide

2871-3872 Screening compound: (2Z)-N-(2-bromo-4-methylphenyl)-2-[(3,4-dimethoxyphenyl)formamido]-3-(2-methoxyphenyl)prop-2-enamide
2871-3872 Screening compound: (2Z)-N-(2-bromo-4-methylphenyl)-2-[(3,4-dimethoxyphenyl)formamido]-3-(2-methoxyphenyl)prop-2-enamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2871-3872
(2Z)-N-(2-bromo-4-methylphenyl)-2-[(3,4-dimethoxyphenyl)formamido]-3-(2-methoxyphenyl)prop-2-enamide

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

2871-3872

Molecular Formula

C26H25BrN2O5 (C26 H25 BrN2 O5)

Compound Name

(2Z)-N-(2-bromo-4-methylphenyl)-2-[(3,4-dimethoxyphenyl)formamido]-3-(2-methoxyphenyl)prop-2-enamide

IUPAC name

(2Z)-N-(2-bromo-4-methylphenyl)-2-[(34-dimethoxyphenyl)formamido]-3-(2-methoxyphenyl)prop-2-enamide

SMILES

Cc(cc1)cc(Br)c1NC(/C(/NC(c(cc1)cc(OC)c1OC)=O)=C/c(cccc1)c1OC)=O

InChI

InChI=1S/C26H25BrN2O5/c1-16-9-11-20(19(27)13-16)28-26(31)21(14-17-7-5-6-8-22(17)32-2)29-25(30)18-10-12-23(33-3)24(15-18)34-4/h5-15H,1-4H3,(H,28,31)(H,29,30)

InChI Key

YQDFDCPVMBXNMD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01933053

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

525.4

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.062

Distribution Coefficient, logD

5.030

Water Solubility, LogSw

-4.74

Polar Surface Area

67.448

Acid Dissociation Constant (pKa)

8.51

Base Dissociation Constant (pKb)

3.50

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.40

2871-3872 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin

References: we are preparing a list of scientific research reports with 2871-3872 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2871-3872?
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What is the minimum amount of 2871-3872 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2871-3872
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2871-3872
  • 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 2871-3872 available by request