Y070-1200 Screening compound: 5-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-methyl-1,3-oxazole-4-carbonitrile

Y070-1200 Screening compound: 5-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-methyl-1,3-oxazole-4-carbonitrile
Y070-1200 Screening compound: 5-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-methyl-1,3-oxazole-4-carbonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound Y070-1200
5-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-methyl-1,3-oxazole-4-carbonitrile

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

Y070-1200

Molecular Formula

C15H17N3O3 (C15 H17 N3 O3)

Compound Name

5-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-methyl-1,3-oxazole-4-carbonitrile

IUPAC name

5-{[2-(34-dimethoxyphenyl)ethyl]amino}-2-methyl-13-oxazole-4-carbonitrile

SMILES

Cc1nc(C#N)c(NCCc(cc2)cc(OC)c2OC)o1

InChI

InChI=1S/C15H17N3O3/c1-10-18-12(9-16)15(21-10)17-7-6-11-4-5-13(19-2)14(8-11)20-3/h4-5,8,17H,6-7H2,1-3H3

InChI Key

XJOGGYZJZXZXOL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03463747

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

287.32

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.514

Distribution Coefficient, logD

1.514

Water Solubility, LogSw

-1.98

Polar Surface Area

60.879

Acid Dissociation Constant (pKa)

14.12

Base Dissociation Constant (pKb)

-2.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

Y070-1200 in Drug Discovery

Included in Screening Libraries

CNS MPO Library (28609 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with Y070-1200 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y070-1200?
Check Price and Availability of Y070-1200, 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 Y070-1200 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y070-1200
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y070-1200
  • 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 Y070-1200 available by request