P664-0209 Screening compound: 2-(3,4-dimethoxyphenyl)-1-(4-{3,5-dimethyl-[1,2,4]triazolo[4,3-a]pyrimidin-7-yl}piperazin-1-yl)ethan-1-one

P664-0209 Screening compound: 2-(3,4-dimethoxyphenyl)-1-(4-{3,5-dimethyl-[1,2,4]triazolo[4,3-a]pyrimidin-7-yl}piperazin-1-yl)ethan-1-one
P664-0209 Screening compound: 2-(3,4-dimethoxyphenyl)-1-(4-{3,5-dimethyl-[1,2,4]triazolo[4,3-a]pyrimidin-7-yl}piperazin-1-yl)ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound P664-0209
2-(3,4-dimethoxyphenyl)-1-(4-{3,5-dimethyl-[1,2,4]triazolo[4,3-a]pyrimidin-7-yl}piperazin-1-yl)ethan-1-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

P664-0209

Molecular Formula

C21H26N6O3 (C21 H26 N6 O3)

Compound Name

2-(3,4-dimethoxyphenyl)-1-(4-{3,5-dimethyl-[1,2,4]triazolo[4,3-a]pyrimidin-7-yl}piperazin-1-yl)ethan-1-one

IUPAC name

2-(34-dimethoxyphenyl)-1-(4-{35-dimethyl-[124]triazolo[43-a]pyrimidin-7-yl}piperazin-1-yl)ethan-1-one

SMILES

Cc(n1c(C)c2)nnc1nc2N(CC1)CCN1C(Cc(cc1)cc(OC)c1OC)=O

InChI

InChI=1S/C21H26N6O3/c1-14-11-19(22-21-24-23-15(2)27(14)21)25-7-9-26(10-8-25)20(28)13-16-5-6-17(29-3)18(12-16)30-4/h5-6,11-12H,7-10,13H2,1-4H3

InChI Key

KBPULPKSMJDQAC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27609997

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

410.48

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.401

Distribution Coefficient, logD

1.400

Water Solubility, LogSw

-1.94

Polar Surface Area

66.419

Acid Dissociation Constant (pKa)

18.21

Base Dissociation Constant (pKb)

4.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.90

P664-0209 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with P664-0209 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P664-0209?
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What is the minimum amount of P664-0209 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P664-0209
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P664-0209
  • 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 P664-0209 available by request