V001-4950 Screening compound: N-cyclohexyl-N-{2-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl}-2-thiophenecarboxamide

V001-4950 Screening compound: N-cyclohexyl-N-{2-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl}-2-thiophenecarboxamide
V001-4950 Screening compound: N-cyclohexyl-N-{2-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl}-2-thiophenecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V001-4950
N-cyclohexyl-N-{2-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl}-2-thiophenecarboxamide

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

V001-4950

Molecular Formula

C22H25N3O2S (C22 H25 N3 O2 S)

Compound Name

N-cyclohexyl-N-{2-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl}-2-thiophenecarboxamide

IUPAC name

N-cyclohexyl-N-{2-[3-(4-methylphenyl)-124-oxadiazol-5-yl]ethyl}thiophene-2-carboxamide

SMILES

Cc(cc1)ccc1-c1noc(CCN(C2CCCCC2)C(c2cccs2)=O)n1

InChI

InChI=1S/C22H25N3O2S/c1-16-9-11-17(12-10-16)21-23-20(27-24-21)13-14-25(18-6-3-2-4-7-18)22(26)19-8-5-15-28-19/h5,8-12,15,18H,2-4,6-7,13-14H2,1H3

InChI Key

SFWBBRAFKLUIRZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19781125

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

395.53

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.025

Distribution Coefficient, logD

6.025

Water Solubility, LogSw

-5.26

Polar Surface Area

47.762

Acid Dissociation Constant (pKa)

27.80

Base Dissociation Constant (pKb)

0.81

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.91

V001-4950 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 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 V001-4950 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V001-4950?
Check Price and Availability of V001-4950, 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 V001-4950 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V001-4950
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V001-4950
  • 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 V001-4950 available by request