4327-2609 Screening compound: N-[1-(adamantan-1-yl)ethyl]-5-(3-chloro-2-methylphenyl)furan-2-carboxamide

4327-2609 Screening compound: N-[1-(adamantan-1-yl)ethyl]-5-(3-chloro-2-methylphenyl)furan-2-carboxamide
4327-2609 Screening compound: N-[1-(adamantan-1-yl)ethyl]-5-(3-chloro-2-methylphenyl)furan-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4327-2609
N-[1-(adamantan-1-yl)ethyl]-5-(3-chloro-2-methylphenyl)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

4327-2609

Molecular Formula

C24H28ClNO2 (C24 H28 ClNO2)

Compound Name

N-[1-(adamantan-1-yl)ethyl]-5-(3-chloro-2-methylphenyl)furan-2-carboxamide

IUPAC name

5-(3-chloro-2-methylphenyl)-N-{1-[(3R5S7s)-adamantan-1-yl]ethyl}furan-2-carboxamide

SMILES

CC(C1(C[C@H](C2)C3)C[C@H]3C[C@H]2C1)NC(c1ccc(-c2cccc(Cl)c2C)o1)=O

InChI

InChI=1S/C24H28ClNO2/c1-14-19(4-3-5-20(14)25)21-6-7-22(28-21)23(27)26-15(2)24-11-16-8-17(12-24)10-18(9-16)13-24/h3-7,15-18H,8-13H2,1-2H3,(H,26,27)/t15-,16?,17?,18?,24?/m0/s1

InChI Key

IGNAZVFTVFIOQD-KSKOPSKJSA-N

MDL Number (MFCD)

MFCD02904666

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

397.94

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

6.433

Distribution Coefficient, logD

6.433

Water Solubility, LogSw

-6.12

Polar Surface Area

32.248

Acid Dissociation Constant (pKa)

14.27

Base Dissociation Constant (pKb)

-1.36

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

54.20

4327-2609 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Histone Deacetylases (HDAC) Targeted Library (9760 compounds)

New Agro Library (44492 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Endocrine
  • Immune system
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Mechanism of action:
  • Epigenetic
Agro:
  • Agro
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with 4327-2609 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4327-2609?
Check Price and Availability of 4327-2609, 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 4327-2609 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4327-2609
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4327-2609
  • 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 4327-2609 available by request