C590-0253 Screening compound: 1-[3-(2-methoxyphenyl)-1H-pyrazole-5-carbonyl]-4-(pyridin-2-yl)piperazine

C590-0253 Screening compound: 1-[3-(2-methoxyphenyl)-1H-pyrazole-5-carbonyl]-4-(pyridin-2-yl)piperazine
C590-0253 Screening compound: 1-[3-(2-methoxyphenyl)-1H-pyrazole-5-carbonyl]-4-(pyridin-2-yl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound C590-0253
1-[3-(2-methoxyphenyl)-1H-pyrazole-5-carbonyl]-4-(pyridin-2-yl)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

C590-0253

Molecular Formula

C20H21N5O2 (C20 H21 N5 O2)

Compound Name

1-[3-(2-methoxyphenyl)-1H-pyrazole-5-carbonyl]-4-(pyridin-2-yl)piperazine

IUPAC name

1-[3-(2-methoxyphenyl)-1H-pyrazole-5-carbonyl]-4-(pyridin-2-yl)piperazine

SMILES

COc(cccc1)c1-c1n[nH]c(C(N(CC2)CCN2c2ncccc2)=O)c1

InChI

InChI=1S/C20H21N5O2/c1-27-18-7-3-2-6-15(18)16-14-17(23-22-16)20(26)25-12-10-24(11-13-25)19-8-4-5-9-21-19/h2-9,14H,10-13H2,1H3,(H,22,23)

InChI Key

INCFTMBSVDXVOP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14773212

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

363.42

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.934

Distribution Coefficient, logD

2.925

Water Solubility, LogSw

-3.48

Polar Surface Area

58.779

Acid Dissociation Constant (pKa)

9.03

Base Dissociation Constant (pKb)

5.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

C590-0253 in Drug Discovery

Included in Screening Libraries

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C590-0253 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C590-0253?
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What is the minimum amount of C590-0253 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C590-0253
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C590-0253
  • 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 C590-0253 available by request