G612-0952 Screening compound: tert-butyl 4-[1-(4-chlorophenyl)-4-{[(4-chlorophenyl)methyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate

G612-0952 Screening compound: tert-butyl 4-[1-(4-chlorophenyl)-4-{[(4-chlorophenyl)methyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate
G612-0952 Screening compound: tert-butyl 4-[1-(4-chlorophenyl)-4-{[(4-chlorophenyl)methyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound G612-0952
tert-butyl 4-[1-(4-chlorophenyl)-4-{[(4-chlorophenyl)methyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate

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

G612-0952

Molecular Formula

C27H30Cl2N4O3 (C27 H30 Cl2 N4 O3)

Compound Name

tert-butyl 4-[1-(4-chlorophenyl)-4-{[(4-chlorophenyl)methyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate

IUPAC name

tert-butyl 4-[1-(4-chlorophenyl)-4-{[(4-chlorophenyl)methyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate

SMILES

CC(C)(C)OC(N(CC1)CCC1c(n(-c(cc1)ccc1Cl)nc1)c1C(NCc(cc1)ccc1Cl)=O)=O

InChI

InChI=1S/C27H30Cl2N4O3/c1-27(2,3)36-26(35)32-14-12-19(13-15-32)24-23(17-31-33(24)22-10-8-21(29)9-11-22)25(34)30-16-18-4-6-20(28)7-5-18/h4-11,17,19H,12-16H2,1-3H3,(H,30,34)

InChI Key

JSXKIFWQDVFKQV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15022947

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

529.47

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

7.102

Distribution Coefficient, logD

7.102

Water Solubility, LogSw

-6.27

Polar Surface Area

59.556

Acid Dissociation Constant (pKa)

11.54

Base Dissociation Constant (pKb)

1.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.00

References: we are preparing a list of scientific research reports with G612-0952 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G612-0952?
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What is the minimum amount of G612-0952 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G612-0952
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G612-0952
  • 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 G612-0952 available by request