C430-0928 Screening compound: 5-{1-[(tert-butoxy)carbonyl]piperidin-4-yl}-1-(3-chlorophenyl)-1H-pyrazole-4-carboxylic acid

C430-0928 Screening compound: 5-{1-[(tert-butoxy)carbonyl]piperidin-4-yl}-1-(3-chlorophenyl)-1H-pyrazole-4-carboxylic acid
C430-0928 Screening compound: 5-{1-[(tert-butoxy)carbonyl]piperidin-4-yl}-1-(3-chlorophenyl)-1H-pyrazole-4-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound C430-0928
5-{1-[(tert-butoxy)carbonyl]piperidin-4-yl}-1-(3-chlorophenyl)-1H-pyrazole-4-carboxylic acid

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

C430-0928

Molecular Formula

C20H24ClN3O4 (C20 H24 ClN3 O4)

Compound Name

5-{1-[(tert-butoxy)carbonyl]piperidin-4-yl}-1-(3-chlorophenyl)-1H-pyrazole-4-carboxylic acid

IUPAC name

5-{1-[(tert-butoxy)carbonyl]piperidin-4-yl}-1-(3-chlorophenyl)-1H-pyrazole-4-carboxylic acid

SMILES

CC(C)(C)OC(N(CC1)CCC1c(n(-c1cccc(Cl)c1)nc1)c1C(O)=O)=O

InChI

InChI=1S/C20H24ClN3O4/c1-20(2,3)28-19(27)23-9-7-13(8-10-23)17-16(18(25)26)12-22-24(17)15-6-4-5-14(21)11-15/h4-6,11-13H,7-10H2,1-3H3,(H,25,26)

InChI Key

CAZZMMGWQRKHJY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14756670

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

405.88

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.363

Distribution Coefficient, logD

1.008

Water Solubility, LogSw

-5.56

Polar Surface Area

63.551

Acid Dissociation Constant (pKa)

3.05

Base Dissociation Constant (pKb)

1.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.00

References: we are preparing a list of scientific research reports with C430-0928 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C430-0928?
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What is the minimum amount of C430-0928 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C430-0928
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C430-0928
  • 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 C430-0928 available by request