D101-0001 Screening compound: N-cyclohexyl-3,4-dimethoxy-N-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]benzamide

D101-0001 Screening compound: N-cyclohexyl-3,4-dimethoxy-N-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]benzamide
D101-0001 Screening compound: N-cyclohexyl-3,4-dimethoxy-N-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D101-0001
N-cyclohexyl-3,4-dimethoxy-N-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]benzamide

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

D101-0001

Molecular Formula

C24H27N3O4 (C24 H27 N3 O4)

Compound Name

N-cyclohexyl-3,4-dimethoxy-N-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]benzamide

IUPAC name

N-cyclohexyl-34-dimethoxy-N-[(3-phenyl-124-oxadiazol-5-yl)methyl]benzamide

SMILES

COc(ccc(C(N(Cc1nc(-c2ccccc2)no1)C1CCCCC1)=O)c1)c1OC

InChI

InChI=1S/C24H27N3O4/c1-29-20-14-13-18(15-21(20)30-2)24(28)27(19-11-7-4-8-12-19)16-22-25-23(26-31-22)17-9-5-3-6-10-17/h3,5-6,9-10,13-15,19H,4,7-8,11-12,16H2,1-2H3

InChI Key

BGJYHERRFNFQER-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14811820

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

421.5

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.775

Distribution Coefficient, logD

4.775

Water Solubility, LogSw

-4.64

Polar Surface Area

62.026

Acid Dissociation Constant (pKa)

26.96

Base Dissociation Constant (pKb)

-5.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

D101-0001 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

CORONAVIRUS Library (20774 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with D101-0001 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D101-0001?
Check Price and Availability of D101-0001, 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 D101-0001 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D101-0001
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D101-0001
  • 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 D101-0001 available by request