Y041-2999 Screening compound: 6-chloro-2-oxo-4-phenyl-2H-chromen-7-yl 2-{[(benzyloxy)carbonyl]amino}acetate

Y041-2999 Screening compound: 6-chloro-2-oxo-4-phenyl-2H-chromen-7-yl 2-{[(benzyloxy)carbonyl]amino}acetate
Y041-2999 Screening compound: 6-chloro-2-oxo-4-phenyl-2H-chromen-7-yl 2-{[(benzyloxy)carbonyl]amino}acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y041-2999
6-chloro-2-oxo-4-phenyl-2H-chromen-7-yl 2-{[(benzyloxy)carbonyl]amino}acetate

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

Y041-2999

Molecular Formula

C25H18ClNO6 (C25 H18 ClNO6)

Compound Name

6-chloro-2-oxo-4-phenyl-2H-chromen-7-yl 2-{[(benzyloxy)carbonyl]amino}acetate

IUPAC name

6-chloro-2-oxo-4-phenyl-2H-chromen-7-yl 2-{[(benzyloxy)carbonyl]amino}acetate

SMILES

O=C(CNC(OCc1ccccc1)=O)Oc(cc(c(C(c1ccccc1)=C1)c2)OC1=O)c2Cl

InChI

InChI=1S/C25H18ClNO6/c26-20-11-19-18(17-9-5-2-6-10-17)12-23(28)32-21(19)13-22(20)33-24(29)14-27-25(30)31-15-16-7-3-1-4-8-16/h1-13H,14-15H2,(H,27,30)

InChI Key

RDLLUIGPQHVJSD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00791692

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

463.87

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.620

Distribution Coefficient, logD

4.620

Water Solubility, LogSw

-4.85

Polar Surface Area

73.385

Acid Dissociation Constant (pKa)

12.60

Base Dissociation Constant (pKb)

-4.40

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.00

Y041-2999 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Human Proteases Annotated Library (2868 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with Y041-2999 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y041-2999?
Check Price and Availability of Y041-2999, 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 Y041-2999 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y041-2999
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y041-2999
  • 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 Y041-2999 available by request