7482-1732 Screening compound: N-(adamantan-1-yl)-2-(2-phenylmethanesulfonyl-1H-1,3-benzodiazol-1-yl)acetamide

7482-1732 Screening compound: N-(adamantan-1-yl)-2-(2-phenylmethanesulfonyl-1H-1,3-benzodiazol-1-yl)acetamide
7482-1732 Screening compound: N-(adamantan-1-yl)-2-(2-phenylmethanesulfonyl-1H-1,3-benzodiazol-1-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 7482-1732
N-(adamantan-1-yl)-2-(2-phenylmethanesulfonyl-1H-1,3-benzodiazol-1-yl)acetamide

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

7482-1732

Molecular Formula

C26H29N3O3S (C26 H29 N3 O3 S)

Compound Name

N-(adamantan-1-yl)-2-(2-phenylmethanesulfonyl-1H-1,3-benzodiazol-1-yl)acetamide

IUPAC name

N-(adamantan-1-yl)-2-(2-phenylmethanesulfonyl-1H-13-benzodiazol-1-yl)acetamide

SMILES

O=C(Cn1c(S(Cc2ccccc2)(=O)=O)nc2c1cccc2)NC1(CC(C2)C3)CC3CC2C1

InChI

InChI=1S/C26H29N3O3S/c30-24(28-26-13-19-10-20(14-26)12-21(11-19)15-26)16-29-23-9-5-4-8-22(23)27-25(29)33(31,32)17-18-6-2-1-3-7-18/h1-9,19-21H,10-17H2,(H,28,30)

InChI Key

OAGOPKFSNMDRHV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05854332

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

463.6

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.749

Distribution Coefficient, logD

4.749

Water Solubility, LogSw

-4.80

Polar Surface Area

64.052

Acid Dissociation Constant (pKa)

14.17

Base Dissociation Constant (pKb)

2.65

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

46.20

7482-1732 in Drug Discovery

Included in Screening Libraries

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

GPCR Targeted Library (31838 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 7482-1732 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7482-1732?
Check Price and Availability of 7482-1732, 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 7482-1732 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7482-1732
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7482-1732
  • 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 7482-1732 available by request