Y030-6415 Screening compound: 1-(5-methyl-3-phenyl-1,2-oxazole-4-carbonyl)azepane

Y030-6415 Screening compound: 1-(5-methyl-3-phenyl-1,2-oxazole-4-carbonyl)azepane
Y030-6415 Screening compound: 1-(5-methyl-3-phenyl-1,2-oxazole-4-carbonyl)azepane alternative view

Chemical Structure Depiction of ChemDiv screening compound Y030-6415
1-(5-methyl-3-phenyl-1,2-oxazole-4-carbonyl)azepane

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

Y030-6415

Molecular Formula

C17H20N2O2 (C17 H20 N2 O2)

Compound Name

1-(5-methyl-3-phenyl-1,2-oxazole-4-carbonyl)azepane

IUPAC name

1-(5-methyl-3-phenyl-12-oxazole-4-carbonyl)azepane

SMILES

Cc1c(C(N2CCCCCC2)=O)c(-c2ccccc2)no1

InChI

InChI=1S/C17H20N2O2/c1-13-15(17(20)19-11-7-2-3-8-12-19)16(18-21-13)14-9-5-4-6-10-14/h4-6,9-10H,2-3,7-8,11-12H2,1H3

InChI Key

INUMSCPXTSJOAB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03383818

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

284.36

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.036

Distribution Coefficient, logD

3.036

Water Solubility, LogSw

-3.02

Polar Surface Area

39.178

Acid Dissociation Constant (pKa)

27.51

Base Dissociation Constant (pKb)

-0.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.18

Y030-6415 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Dark Chemical Matter Library (18430 compounds)

GABA Library (7115 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Pool
Therapeutical areas:
  • Eye
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with Y030-6415 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y030-6415?
Check Price and Availability of Y030-6415, 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 Y030-6415 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y030-6415
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y030-6415
  • 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 Y030-6415 available by request