D314-0089 Screening compound: 1-[2-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-4-methyl-1,3-thiazole-5-carbonyl]-4-(2-methoxyphenyl)piperazine

D314-0089 Screening compound: 1-[2-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-4-methyl-1,3-thiazole-5-carbonyl]-4-(2-methoxyphenyl)piperazine
D314-0089 Screening compound: 1-[2-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-4-methyl-1,3-thiazole-5-carbonyl]-4-(2-methoxyphenyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound D314-0089
1-[2-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-4-methyl-1,3-thiazole-5-carbonyl]-4-(2-methoxyphenyl)piperazine

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

D314-0089

Molecular Formula

C21H24ClN5O2S (C21 H24 ClN5 O2 S)

Compound Name

1-[2-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-4-methyl-1,3-thiazole-5-carbonyl]-4-(2-methoxyphenyl)piperazine

IUPAC name

1-[2-(4-chloro-35-dimethyl-1H-pyrazol-1-yl)-4-methyl-13-thiazole-5-carbonyl]-4-(2-methoxyphenyl)piperazine

SMILES

Cc(n(-c1nc(C)c(C(N(CC2)CCN2c(cccc2)c2OC)=O)s1)nc1C)c1Cl

InChI

InChI=1S/C21H24ClN5O2S/c1-13-18(22)15(3)27(24-13)21-23-14(2)19(30-21)20(28)26-11-9-25(10-12-26)16-7-5-6-8-17(16)29-4/h5-8H,9-12H2,1-4H3

InChI Key

XCFMZNKHSLZHMT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14817990

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

445.97

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.737

Distribution Coefficient, logD

3.732

Water Solubility, LogSw

-4.35

Polar Surface Area

52.292

Acid Dissociation Constant (pKa)

28.47

Base Dissociation Constant (pKb)

5.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.10

D314-0089 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with D314-0089 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D314-0089?
Check Price and Availability of D314-0089, 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 D314-0089 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D314-0089
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D314-0089
  • 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 D314-0089 available by request