V031-3193 Screening compound: 3-({[4-(2-fluorophenyl)-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide

V031-3193 Screening compound: 3-({[4-(2-fluorophenyl)-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide
V031-3193 Screening compound: 3-({[4-(2-fluorophenyl)-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V031-3193
3-({[4-(2-fluorophenyl)-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}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

V031-3193

Molecular Formula

C23H19FN4O2S (C23 H19 FN4 O2 S)

Compound Name

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

IUPAC name

3-({[4-(2-fluorophenyl)-5-(3-methoxyphenyl)-4H-124-triazol-3-yl]sulfanyl}methyl)benzamide

SMILES

COc1cccc(-c(n2-c(cccc3)c3F)nnc2SCc2cc(C(N)=O)ccc2)c1

InChI

InChI=1S/C23H19FN4O2S/c1-30-18-9-5-8-17(13-18)22-26-27-23(28(22)20-11-3-2-10-19(20)24)31-14-15-6-4-7-16(12-15)21(25)29/h2-13H,14H2,1H3,(H2,25,29)

InChI Key

ZQNUUYRRFLXOQG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27634229

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

434.49

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.058

Distribution Coefficient, logD

4.058

Water Solubility, LogSw

-4.38

Polar Surface Area

66.014

Acid Dissociation Constant (pKa)

13.51

Base Dissociation Constant (pKb)

1.20

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.70

V031-3193 in Drug Discovery

Included in Screening Libraries

Regenerative Medicine Focused Library (23016 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with V031-3193 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V031-3193?
Check Price and Availability of V031-3193, 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 V031-3193 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V031-3193
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V031-3193
  • 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 V031-3193 available by request