Y070-2241 Screening compound: (2E)-2-(benzenesulfonyl)-3-[2-(2,6-dimethylmorpholin-4-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enenitrile

Y070-2241 Screening compound: (2E)-2-(benzenesulfonyl)-3-[2-(2,6-dimethylmorpholin-4-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enenitrile
Y070-2241 Screening compound: (2E)-2-(benzenesulfonyl)-3-[2-(2,6-dimethylmorpholin-4-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enenitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound Y070-2241
(2E)-2-(benzenesulfonyl)-3-[2-(2,6-dimethylmorpholin-4-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enenitrile

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

Y070-2241

Molecular Formula

C23H22N4O4S (C23 H22 N4 O4 S)

Compound Name

(2E)-2-(benzenesulfonyl)-3-[2-(2,6-dimethylmorpholin-4-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enenitrile

IUPAC name

(2E)-2-(benzenesulfonyl)-3-[2-(26-dimethylmorpholin-4-yl)-4-oxo-4H-pyrido[12-a]pyrimidin-3-yl]prop-2-enenitrile

SMILES

CC(C1)OC(C)CN1C(N=C1N2C=CC=C1)=C(/C=C(\C#N)/S(c1ccccc1)(=O)=O)C2=O

InChI

InChI=1S/C23H22N4O4S/c1-16-14-26(15-17(2)31-16)22-20(23(28)27-11-7-6-10-21(27)25-22)12-19(13-24)32(29,30)18-8-4-3-5-9-18/h3-12,16-17H,14-15H2,1-2H3

InChI Key

WNVOUBAWLIELCM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03672524

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

450.52

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.865

Distribution Coefficient, logD

1.865

Water Solubility, LogSw

-2.32

Polar Surface Area

82.521

Acid Dissociation Constant (pKa)

26.45

Base Dissociation Constant (pKb)

0.05

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

26.10

Y070-2241 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with Y070-2241 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y070-2241?
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What is the minimum amount of Y070-2241 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y070-2241
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y070-2241
  • 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 Y070-2241 available by request