V016-7590 Screening compound: 3-methyl-5-(3-pyridyl)-N~4~-(1,2,3,4-tetrahydro-1-naphthalenyl)-4-isoxazolecarboxamide

V016-7590 Screening compound: 3-methyl-5-(3-pyridyl)-N~4~-(1,2,3,4-tetrahydro-1-naphthalenyl)-4-isoxazolecarboxamide
V016-7590 Screening compound: 3-methyl-5-(3-pyridyl)-N~4~-(1,2,3,4-tetrahydro-1-naphthalenyl)-4-isoxazolecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V016-7590
3-methyl-5-(3-pyridyl)-N~4~-(1,2,3,4-tetrahydro-1-naphthalenyl)-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

V016-7590

Molecular Formula

C20H19N3O2 (C20 H19 N3 O2)

Compound Name

3-methyl-5-(3-pyridyl)-N~4~-(1,2,3,4-tetrahydro-1-naphthalenyl)-4-isoxazolecarboxamide

IUPAC name

n/a

SMILES

Cc1noc(-c2cnccc2)c1C(NC(CCC1)c2c1cccc2)=O

InChI

InChI=1S/C20H19N3O2/c1-13-18(19(25-23-13)15-8-5-11-21-12-15)20(24)22-17-10-4-7-14-6-2-3-9-16(14)17/h2-3,5-6,8-9,11-12,17H,4,7,10H2,1H3,(H,22,24)/t17-/m0/s1

InChI Key

IDSWJDYHAXVISX-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD19954965

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

333.39

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.995

Distribution Coefficient, logD

2.995

Water Solubility, LogSw

-3.06

Polar Surface Area

56.359

Acid Dissociation Constant (pKa)

11.42

Base Dissociation Constant (pKb)

3.95

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

25.00

V016-7590 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

Antiparasite Library (23996 compounds)

GPCR Targeted Library (31838 compounds)

Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with V016-7590 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V016-7590?
Check Price and Availability of V016-7590, 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 V016-7590 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V016-7590
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V016-7590
  • 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 V016-7590 available by request