V020-5901 Screening compound: 3-methyl-5-(2-methylphenyl)-N-(4-pyridylmethyl)-4-isoxazolecarboxamide

V020-5901 Screening compound: 3-methyl-5-(2-methylphenyl)-N-(4-pyridylmethyl)-4-isoxazolecarboxamide
V020-5901 Screening compound: 3-methyl-5-(2-methylphenyl)-N-(4-pyridylmethyl)-4-isoxazolecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V020-5901
3-methyl-5-(2-methylphenyl)-N-(4-pyridylmethyl)-4-isoxazolecarboxamide

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

V020-5901

Molecular Formula

C18H17N3O2 (C18 H17 N3 O2)

Compound Name

3-methyl-5-(2-methylphenyl)-N-(4-pyridylmethyl)-4-isoxazolecarboxamide

IUPAC name

3-methyl-5-(2-methylphenyl)-N-[(pyridin-4-yl)methyl]-12-oxazole-4-carboxamide

SMILES

Cc1noc(-c2c(C)cccc2)c1C(NCc1ccncc1)=O

InChI

InChI=1S/C18H17N3O2/c1-12-5-3-4-6-15(12)17-16(13(2)21-23-17)18(22)20-11-14-7-9-19-10-8-14/h3-10H,11H2,1-2H3,(H,20,22)

InChI Key

XWAIPRACUFAUGL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19958993

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

307.35

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.268

Distribution Coefficient, logD

2.265

Water Solubility, LogSw

-2.57

Polar Surface Area

56.425

Acid Dissociation Constant (pKa)

13.64

Base Dissociation Constant (pKb)

5.29

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.67

V020-5901 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

GPCR Targeted Library (31838 compounds)

Glucocorticoid receptors Library (4806 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Endocrine
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Agro:
  • Agro
Targets:
  • GPCR
  • Nuclear receptors
  • Proteases
Mechanism of action:
  • Receptor's ligands
  • Receptor's ligands

References: we are preparing a list of scientific research reports with V020-5901 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V020-5901?
Check Price and Availability of V020-5901, 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 V020-5901 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V020-5901
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V020-5901
  • 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 V020-5901 available by request