V030-8810 Screening compound: 1-[5-(furan-3-yl)-1-(4-methylphenyl)-1H-1,2,4-triazole-3-carbonyl]piperidine-4-carboxamide

V030-8810 Screening compound: 1-[5-(furan-3-yl)-1-(4-methylphenyl)-1H-1,2,4-triazole-3-carbonyl]piperidine-4-carboxamide
V030-8810 Screening compound: 1-[5-(furan-3-yl)-1-(4-methylphenyl)-1H-1,2,4-triazole-3-carbonyl]piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V030-8810
1-[5-(furan-3-yl)-1-(4-methylphenyl)-1H-1,2,4-triazole-3-carbonyl]piperidine-4-carboxamide

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

V030-8810

Molecular Formula

C20H21N5O3 (C20 H21 N5 O3)

Compound Name

1-[5-(furan-3-yl)-1-(4-methylphenyl)-1H-1,2,4-triazole-3-carbonyl]piperidine-4-carboxamide

IUPAC name

1-[5-(furan-3-yl)-1-(4-methylphenyl)-1H-124-triazole-3-carbonyl]piperidine-4-carboxamide

SMILES

Cc(cc1)ccc1-n1nc(C(N(CC2)CCC2C(N)=O)=O)nc1-c1cocc1

InChI

InChI=1S/C20H21N5O3/c1-13-2-4-16(5-3-13)25-19(15-8-11-28-12-15)22-18(23-25)20(27)24-9-6-14(7-10-24)17(21)26/h2-5,8,11-12,14H,6-7,9-10H2,1H3,(H2,21,26)

InChI Key

NPAPISUBXRSKKI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14287388

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

379.42

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.981

Distribution Coefficient, logD

1.981

Water Solubility, LogSw

-2.19

Polar Surface Area

82.400

Acid Dissociation Constant (pKa)

14.92

Base Dissociation Constant (pKb)

4.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

V030-8810 in Drug Discovery

Included in Screening Libraries

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

Macl-GPIb alpha Interaction Library (22969 compounds)

SH2 Library (10483 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular
  • Cancer
  • Endocrine
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Mechanism of action:
  • PPI modulators
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with V030-8810 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V030-8810?
Check Price and Availability of V030-8810, 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 V030-8810 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V030-8810
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V030-8810
  • 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 V030-8810 available by request