V024-6314 Screening compound: 4-({[4-ethyl-5-(4-nitrophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-(4-fluorophenyl)benzamide

V024-6314 Screening compound: 4-({[4-ethyl-5-(4-nitrophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-(4-fluorophenyl)benzamide
V024-6314 Screening compound: 4-({[4-ethyl-5-(4-nitrophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-(4-fluorophenyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V024-6314
4-({[4-ethyl-5-(4-nitrophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-(4-fluorophenyl)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

V024-6314

Molecular Formula

C24H20FN5O3S (C24 H20 FN5 O3 S)

Compound Name

4-({[4-ethyl-5-(4-nitrophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-(4-fluorophenyl)benzamide

IUPAC name

4-({[4-ethyl-5-(4-nitrophenyl)-4H-124-triazol-3-yl]sulfanyl}methyl)-N-(4-fluorophenyl)benzamide

SMILES

CCn1c(SCc(cc2)ccc2C(Nc(cc2)ccc2F)=O)nnc1-c(cc1)ccc1[N+]([O-])=O

InChI

InChI=1S/C24H20FN5O3S/c1-2-29-22(17-7-13-21(14-8-17)30(32)33)27-28-24(29)34-15-16-3-5-18(6-4-16)23(31)26-20-11-9-19(25)10-12-20/h3-14H,2,15H2,1H3,(H,26,31)

InChI Key

DYGXKPKGJWJCMT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19782080

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

477.52

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.940

Distribution Coefficient, logD

4.934

Water Solubility, LogSw

-4.62

Polar Surface Area

80.438

Acid Dissociation Constant (pKa)

9.31

Base Dissociation Constant (pKb)

3.20

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

V024-6314 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with V024-6314 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V024-6314?
Check Price and Availability of V024-6314, 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 V024-6314 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V024-6314
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V024-6314
  • 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 V024-6314 available by request