V018-7456 Screening compound: N-[(2-CHLORO-6-METHYLPHENYL)METHYL]-3-METHYL-5-(PYRIDIN-3-YL)-1,2-OXAZOLE-4-CARBOXAMIDE

V018-7456 Screening compound: N-[(2-CHLORO-6-METHYLPHENYL)METHYL]-3-METHYL-5-(PYRIDIN-3-YL)-1,2-OXAZOLE-4-CARBOXAMIDE
V018-7456 Screening compound: N-[(2-CHLORO-6-METHYLPHENYL)METHYL]-3-METHYL-5-(PYRIDIN-3-YL)-1,2-OXAZOLE-4-CARBOXAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound V018-7456
N-[(2-CHLORO-6-METHYLPHENYL)METHYL]-3-METHYL-5-(PYRIDIN-3-YL)-1,2-OXAZOLE-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

V018-7456

Molecular Formula

C18H16ClN3O2 (C18 H16 ClN3 O2)

Compound Name

N-[(2-CHLORO-6-METHYLPHENYL)METHYL]-3-METHYL-5-(PYRIDIN-3-YL)-1,2-OXAZOLE-4-CARBOXAMIDE

IUPAC name

N-[(2-chloro-6-methylphenyl)methyl]-3-methyl-5-(pyridin-3-yl)-12-oxazole-4-carboxamide

SMILES

Cc1noc(-c2cnccc2)c1C(NCc(c(C)ccc1)c1Cl)=O

InChI

InChI=1S/C18H16ClN3O2/c1-11-5-3-7-15(19)14(11)10-21-18(23)16-12(2)22-24-17(16)13-6-4-8-20-9-13/h3-9H,10H2,1-2H3,(H,21,23)

InChI Key

YNJYPQQMNZGUSG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19959301

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

341.8

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

3.537

Distribution Coefficient, logD

3.537

Water Solubility, LogSw

-4.19

Polar Surface Area

56.515

Acid Dissociation Constant (pKa)

11.70

Base Dissociation Constant (pKb)

3.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.67

V018-7456 in Drug Discovery

Included in Screening Libraries

BRD4 Targeted Library (4534 compounds)

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

Glucocorticoid receptors Library (4806 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Hemic and lymphatic
  • Cardiovascular
  • Metabolic
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Endocrine
  • Cancer
  • Digestive system
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Immune system
Targets:
  • Others
  • Nuclear receptors
  • Others
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with V018-7456 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V018-7456?
Check Price and Availability of V018-7456, 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 V018-7456 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V018-7456
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V018-7456
  • 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 V018-7456 available by request