V030-4035 Screening compound: 3-cyclohexyl-1-(2,4-difluorophenyl)-3-{2-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}urea

V030-4035 Screening compound: 3-cyclohexyl-1-(2,4-difluorophenyl)-3-{2-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}urea
V030-4035 Screening compound: 3-cyclohexyl-1-(2,4-difluorophenyl)-3-{2-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}urea alternative view

Chemical Structure Depiction of ChemDiv screening compound V030-4035
3-cyclohexyl-1-(2,4-difluorophenyl)-3-{2-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}urea

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

V030-4035

Molecular Formula

C25H28F2N4O4 (C25 H28 F2 N4 O4)

Compound Name

3-cyclohexyl-1-(2,4-difluorophenyl)-3-{2-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}urea

IUPAC name

3-cyclohexyl-1-(24-difluorophenyl)-3-{2-[3-(34-dimethoxyphenyl)-124-oxadiazol-5-yl]ethyl}urea

SMILES

COc(ccc(-c1noc(CCN(C2CCCCC2)C(Nc(ccc(F)c2)c2F)=O)n1)c1)c1OC

InChI

InChI=1S/C25H28F2N4O4/c1-33-21-11-8-16(14-22(21)34-2)24-29-23(35-30-24)12-13-31(18-6-4-3-5-7-18)25(32)28-20-10-9-17(26)15-19(20)27/h8-11,14-15,18H,3-7,12-13H2,1-2H3,(H,28,32)

InChI Key

FHBCPKJILPEQKT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD20493695

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

486.52

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.769

Distribution Coefficient, logD

5.768

Water Solubility, LogSw

-5.44

Polar Surface Area

70.128

Acid Dissociation Constant (pKa)

10.70

Base Dissociation Constant (pKb)

3.48

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

V030-4035 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

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

CORONAVIRUS Library (20774 compounds)

Regenerative Medicine Focused Library (23016 compounds)

New Agro Library (44492 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
Agro:
  • Agro

References: we are preparing a list of scientific research reports with V030-4035 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V030-4035?
Check Price and Availability of V030-4035, 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 V030-4035 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V030-4035
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V030-4035
  • 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 V030-4035 available by request