Y200-5087 Screening compound: methyl 4,5-dimethoxy-2-(5-methyl-3-phenyl-1,2-oxazole-4-amido)benzoate

Y200-5087 Screening compound: methyl 4,5-dimethoxy-2-(5-methyl-3-phenyl-1,2-oxazole-4-amido)benzoate
Y200-5087 Screening compound: methyl 4,5-dimethoxy-2-(5-methyl-3-phenyl-1,2-oxazole-4-amido)benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y200-5087
methyl 4,5-dimethoxy-2-(5-methyl-3-phenyl-1,2-oxazole-4-amido)benzoate

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

Y200-5087

Molecular Formula

C21H20N2O6 (C21 H20 N2 O6)

Compound Name

methyl 4,5-dimethoxy-2-(5-methyl-3-phenyl-1,2-oxazole-4-amido)benzoate

IUPAC name

methyl 45-dimethoxy-2-(5-methyl-3-phenyl-12-oxazole-4-amido)benzoate

SMILES

Cc1c(C(Nc(cc(c(OC)c2)OC)c2C(OC)=O)=O)c(-c2ccccc2)no1

InChI

InChI=1S/C21H20N2O6/c1-12-18(19(23-29-12)13-8-6-5-7-9-13)20(24)22-15-11-17(27-3)16(26-2)10-14(15)21(25)28-4/h5-11H,1-4H3,(H,22,24)

InChI Key

WUHGRBXEHQZDGJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06004719

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

396.4

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.904

Distribution Coefficient, logD

2.201

Water Solubility, LogSw

-3.56

Polar Surface Area

81.027

Acid Dissociation Constant (pKa)

6.79

Base Dissociation Constant (pKb)

-2.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.00

Y200-5087 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Selective Target Activity Profiling Library (14702 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

References: we are preparing a list of scientific research reports with Y200-5087 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y200-5087?
Check Price and Availability of Y200-5087, 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 Y200-5087 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y200-5087
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y200-5087
  • 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 Y200-5087 available by request