2447-2721 Screening compound: (2Z)-3-[4-(dimethylamino)phenyl]-2-[(2-fluorophenyl)formamido]-N-[4-(hexyloxy)phenyl]prop-2-enamide

2447-2721 Screening compound: (2Z)-3-[4-(dimethylamino)phenyl]-2-[(2-fluorophenyl)formamido]-N-[4-(hexyloxy)phenyl]prop-2-enamide
2447-2721 Screening compound: (2Z)-3-[4-(dimethylamino)phenyl]-2-[(2-fluorophenyl)formamido]-N-[4-(hexyloxy)phenyl]prop-2-enamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2447-2721
(2Z)-3-[4-(dimethylamino)phenyl]-2-[(2-fluorophenyl)formamido]-N-[4-(hexyloxy)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

2447-2721

Molecular Formula

C30H34FN3O3 (C30 H34 FN3 O3)

Compound Name

(2Z)-3-[4-(dimethylamino)phenyl]-2-[(2-fluorophenyl)formamido]-N-[4-(hexyloxy)phenyl]prop-2-enamide

IUPAC name

(2Z)-3-[4-(dimethylamino)phenyl]-2-[(2-fluorophenyl)formamido]-N-[4-(hexyloxy)phenyl]prop-2-enamide

SMILES

CCCCCCOc(cc1)ccc1NC(/C(/NC(c(cccc1)c1F)=O)=C/c(cc1)ccc1N(C)C)=O

InChI

InChI=1S/C30H34FN3O3/c1-4-5-6-9-20-37-25-18-14-23(15-19-25)32-30(36)28(21-22-12-16-24(17-13-22)34(2)3)33-29(35)26-10-7-8-11-27(26)31/h7-8,10-19,21H,4-6,9,20H2,1-3H3,(H,32,36)(H,33,35)

InChI Key

XQODVGXKROHGIH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01842379

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

503.62

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

14.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.827

Distribution Coefficient, logD

6.273

Water Solubility, LogSw

-5.74

Polar Surface Area

55.477

Acid Dissociation Constant (pKa)

6.99

Base Dissociation Constant (pKb)

3.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.70

2447-2721 in Drug Discovery

Included in Screening Libraries

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:
  • 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 2447-2721 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2447-2721?
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What is the minimum amount of 2447-2721 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2447-2721
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2447-2721
  • 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 2447-2721 available by request