Y020-9007 Screening compound: 7,8-dimethyl-3-[2-(morpholin-4-yl)ethyl]-1-[3-(trifluoromethyl)phenyl]-1H,2H,3H,4H,6H-pyrimido[1,2-a][1,3,5]triazin-6-one

Y020-9007 Screening compound: 7,8-dimethyl-3-[2-(morpholin-4-yl)ethyl]-1-[3-(trifluoromethyl)phenyl]-1H,2H,3H,4H,6H-pyrimido[1,2-a][1,3,5]triazin-6-one
Y020-9007 Screening compound: 7,8-dimethyl-3-[2-(morpholin-4-yl)ethyl]-1-[3-(trifluoromethyl)phenyl]-1H,2H,3H,4H,6H-pyrimido[1,2-a][1,3,5]triazin-6-one alternative view

Chemical Structure Depiction of ChemDiv screening compound Y020-9007
7,8-dimethyl-3-[2-(morpholin-4-yl)ethyl]-1-[3-(trifluoromethyl)phenyl]-1H,2H,3H,4H,6H-pyrimido[1,2-a][1,3,5]triazin-6-one

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

Y020-9007

Molecular Formula

C21H26F3N5O2 (C21 H26 F3 N5 O2)

Compound Name

7,8-dimethyl-3-[2-(morpholin-4-yl)ethyl]-1-[3-(trifluoromethyl)phenyl]-1H,2H,3H,4H,6H-pyrimido[1,2-a][1,3,5]triazin-6-one

IUPAC name

78-dimethyl-3-[2-(morpholin-4-yl)ethyl]-1-[3-(trifluoromethyl)phenyl]-1H2H3H4H6H-pyrimido[12-a][135]triazin-6-one

SMILES

CC1=C(C)N=C(N(CN(CCN2CCOCC2)C2)c3cccc(C(F)(F)F)c3)N2C1=O

InChI

InChI=1S/C21H26F3N5O2/c1-15-16(2)25-20-28(18-5-3-4-17(12-18)21(22,23)24)13-27(14-29(20)19(15)30)7-6-26-8-10-31-11-9-26/h3-5,12H,6-11,13-14H2,1-2H3

InChI Key

CDBBKBXHEHRITC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD13873395

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

437.47

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.488

Distribution Coefficient, logD

1.492

Water Solubility, LogSw

-2.55

Polar Surface Area

46.020

Acid Dissociation Constant (pKa)

27.73

Base Dissociation Constant (pKb)

8.35

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

52.40

Y020-9007 in Drug Discovery

Included in Screening Libraries

PI3K-Targeted Library (17255 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with Y020-9007 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y020-9007?
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What is the minimum amount of Y020-9007 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y020-9007
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y020-9007
  • 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 Y020-9007 available by request