8015-0850 Screening compound: N~1~-(2-amino-1-benzyl-2-oxoethyl)-1-adamantanecarboxamide

8015-0850 Screening compound: N~1~-(2-amino-1-benzyl-2-oxoethyl)-1-adamantanecarboxamide
8015-0850 Screening compound: N~1~-(2-amino-1-benzyl-2-oxoethyl)-1-adamantanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8015-0850
N~1~-(2-amino-1-benzyl-2-oxoethyl)-1-adamantanecarboxamide

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

8015-0850

Molecular Formula

C20H26N2O2 (C20 H26 N2 O2)

Compound Name

N~1~-(2-amino-1-benzyl-2-oxoethyl)-1-adamantanecarboxamide

IUPAC name

2-[(adamantan-1-yl)formamido]-3-phenylpropanamide

SMILES

NC(C(Cc1ccccc1)NC(C1(CC(C2)C3)CC3CC2C1)=O)=O

InChI

InChI=1S/C20H26N2O2/c21-18(23)17(9-13-4-2-1-3-5-13)22-19(24)20-10-14-6-15(11-20)8-16(7-14)12-20/h1-5,14-17H,6-12H2,(H2,21,23)(H,22,24)/t14?,15?,16?,17-,20?/m0/s1

InChI Key

BGIXQRSLJHHGTK-FAKMSMKASA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

326.44

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.668

Distribution Coefficient, logD

3.668

Water Solubility, LogSw

-4.14

Polar Surface Area

58.374

Acid Dissociation Constant (pKa)

12.85

Base Dissociation Constant (pKb)

3.20

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

60.00

8015-0850 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 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:
  • 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 8015-0850 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8015-0850?
Check Price and Availability of 8015-0850, 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 8015-0850 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8015-0850
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8015-0850
  • 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 8015-0850 available by request