2733-3732 Screening compound: (2Z)-2-[(5-bromo-2-methoxyphenyl)formamido]-N-(2,4-dimethylphenyl)-3-(3-nitrophenyl)prop-2-enamide

2733-3732 Screening compound: (2Z)-2-[(5-bromo-2-methoxyphenyl)formamido]-N-(2,4-dimethylphenyl)-3-(3-nitrophenyl)prop-2-enamide
2733-3732 Screening compound: (2Z)-2-[(5-bromo-2-methoxyphenyl)formamido]-N-(2,4-dimethylphenyl)-3-(3-nitrophenyl)prop-2-enamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2733-3732
(2Z)-2-[(5-bromo-2-methoxyphenyl)formamido]-N-(2,4-dimethylphenyl)-3-(3-nitrophenyl)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

2733-3732

Molecular Formula

C25H22BrN3O5 (C25 H22 BrN3 O5)

Compound Name

(2Z)-2-[(5-bromo-2-methoxyphenyl)formamido]-N-(2,4-dimethylphenyl)-3-(3-nitrophenyl)prop-2-enamide

IUPAC name

(2Z)-2-[(5-bromo-2-methoxyphenyl)formamido]-N-(24-dimethylphenyl)-3-(3-nitrophenyl)prop-2-enamide

SMILES

Cc(cc1)cc(C)c1NC(/C(/NC(c(cc(cc1)Br)c1OC)=O)=C/c1cc([N+]([O-])=O)ccc1)=O

InChI

InChI=1S/C25H22BrN3O5/c1-15-7-9-21(16(2)11-15)27-25(31)22(13-17-5-4-6-19(12-17)29(32)33)28-24(30)20-14-18(26)8-10-23(20)34-3/h4-14H,1-3H3,(H,27,31)(H,28,30)

InChI Key

RZNGGWYUCOSGMO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01932756

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

524.37

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.625

Distribution Coefficient, logD

4.487

Water Solubility, LogSw

-5.44

Polar Surface Area

85.568

Acid Dissociation Constant (pKa)

6.30

Base Dissociation Constant (pKb)

3.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.00

2733-3732 in Drug Discovery

Included in Screening Libraries

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 2733-3732 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2733-3732?
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What is the minimum amount of 2733-3732 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2733-3732
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2733-3732
  • 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 2733-3732 available by request