P664-0310 Screening compound: 2-(2-chloro-4-methoxyphenyl)-1-(4-{3,5-dimethyl-[1,2,4]triazolo[4,3-a]pyrimidin-7-yl}piperazin-1-yl)ethan-1-one

P664-0310 Screening compound: 2-(2-chloro-4-methoxyphenyl)-1-(4-{3,5-dimethyl-[1,2,4]triazolo[4,3-a]pyrimidin-7-yl}piperazin-1-yl)ethan-1-one
P664-0310 Screening compound: 2-(2-chloro-4-methoxyphenyl)-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 P664-0310
2-(2-chloro-4-methoxyphenyl)-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

P664-0310

Molecular Formula

C20H23ClN6O2 (C20 H23 ClN6 O2)

Compound Name

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

IUPAC name

2-(2-chloro-4-methoxyphenyl)-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(ccc(OC)c1)c1Cl)=O

InChI

InChI=1S/C20H23ClN6O2/c1-13-10-18(22-20-24-23-14(2)27(13)20)25-6-8-26(9-7-25)19(28)11-15-4-5-16(29-3)12-17(15)21/h4-5,10,12H,6-9,11H2,1-3H3

InChI Key

VRJLRLSIZZSYOB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27610028

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

414.89

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.691

Distribution Coefficient, logD

2.690

Water Solubility, LogSw

-3.31

Polar Surface Area

58.702

Acid Dissociation Constant (pKa)

18.21

Base Dissociation Constant (pKb)

4.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

P664-0310 in Drug Discovery

Included in Screening Libraries

Serine Proteases Inhibitors Library (32732 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • 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 P664-0310 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P664-0310?
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What is the minimum amount of P664-0310 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P664-0310
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P664-0310
  • 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 P664-0310 available by request