2447-2762 Screening compound: (2Z)-2-[(2-bromophenyl)formamido]-3-(3-nitrophenyl)-N-[4-(octyloxy)phenyl]prop-2-enamide

2447-2762 Screening compound: (2Z)-2-[(2-bromophenyl)formamido]-3-(3-nitrophenyl)-N-[4-(octyloxy)phenyl]prop-2-enamide
2447-2762 Screening compound: (2Z)-2-[(2-bromophenyl)formamido]-3-(3-nitrophenyl)-N-[4-(octyloxy)phenyl]prop-2-enamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2447-2762
(2Z)-2-[(2-bromophenyl)formamido]-3-(3-nitrophenyl)-N-[4-(octyloxy)phenyl]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

2447-2762

Molecular Formula

C30H32BrN3O5 (C30 H32 BrN3 O5)

Compound Name

(2Z)-2-[(2-bromophenyl)formamido]-3-(3-nitrophenyl)-N-[4-(octyloxy)phenyl]prop-2-enamide

IUPAC name

(2Z)-2-[(2-bromophenyl)formamido]-3-(3-nitrophenyl)-N-[4-(octyloxy)phenyl]prop-2-enamide

SMILES

CCCCCCCCOc(cc1)ccc1NC(/C(/NC(c(cccc1)c1Br)=O)=C/c1cc([N+]([O-])=O)ccc1)=O

InChI

InChI=1S/C30H32BrN3O5/c1-2-3-4-5-6-9-19-39-25-17-15-23(16-18-25)32-30(36)28(21-22-11-10-12-24(20-22)34(37)38)33-29(35)26-13-7-8-14-27(26)31/h7-8,10-18,20-21H,2-6,9,19H2,1H3,(H,32,36)(H,33,35)

InChI Key

PBGKUXNTJOWBAN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02084493

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

594.51

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

16.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

7.863

Distribution Coefficient, logD

7.179

Water Solubility, LogSw

-5.71

Polar Surface Area

86.053

Acid Dissociation Constant (pKa)

6.82

Base Dissociation Constant (pKb)

3.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.70

2447-2762 in Drug Discovery

Included in Screening Libraries

Lipid Metabolism Library (9174 compounds)

MCL1 Targeted Library (12200 compounds)

Regenerative Medicine Focused Library (23016 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Histone Deacetylases (HDAC) Targeted Library (9760 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Metabolic
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Endocrine
  • Immune system
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Mechanism of action:
  • Epigenetic
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with 2447-2762 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2447-2762?
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What is the minimum amount of 2447-2762 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2447-2762
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2447-2762
  • 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 2447-2762 available by request