G612-0969 Screening compound: tert-butyl 4-[1-(4-chlorophenyl)-4-[(3,4,5-trimethoxyphenyl)carbamoyl]-1H-pyrazol-5-yl]piperidine-1-carboxylate

G612-0969 Screening compound: tert-butyl 4-[1-(4-chlorophenyl)-4-[(3,4,5-trimethoxyphenyl)carbamoyl]-1H-pyrazol-5-yl]piperidine-1-carboxylate
G612-0969 Screening compound: tert-butyl 4-[1-(4-chlorophenyl)-4-[(3,4,5-trimethoxyphenyl)carbamoyl]-1H-pyrazol-5-yl]piperidine-1-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound G612-0969
tert-butyl 4-[1-(4-chlorophenyl)-4-[(3,4,5-trimethoxyphenyl)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

G612-0969

Molecular Formula

C29H35ClN4O6 (C29 H35 ClN4 O6)

Compound Name

tert-butyl 4-[1-(4-chlorophenyl)-4-[(3,4,5-trimethoxyphenyl)carbamoyl]-1H-pyrazol-5-yl]piperidine-1-carboxylate

IUPAC name

tert-butyl 4-[1-(4-chlorophenyl)-4-[(345-trimethoxyphenyl)carbamoyl]-1H-pyrazol-5-yl]piperidine-1-carboxylate

SMILES

CC(C)(C)OC(N(CC1)CCC1c(n(-c(cc1)ccc1Cl)nc1)c1C(Nc(cc1OC)cc(OC)c1OC)=O)=O

InChI

InChI=1S/C29H35ClN4O6/c1-29(2,3)40-28(36)33-13-11-18(12-14-33)25-22(17-31-34(25)21-9-7-19(30)8-10-21)27(35)32-20-15-23(37-4)26(39-6)24(16-20)38-5/h7-10,15-18H,11-14H2,1-6H3,(H,32,35)

InChI Key

MIPPNHOWTVOMFY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15022951

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

571.07

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

5.924

Distribution Coefficient, logD

5.917

Water Solubility, LogSw

-6.08

Polar Surface Area

81.212

Acid Dissociation Constant (pKa)

9.19

Base Dissociation Constant (pKb)

1.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.40

References: we are preparing a list of scientific research reports with G612-0969 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G612-0969?
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What is the minimum amount of G612-0969 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G612-0969
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G612-0969
  • 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 G612-0969 available by request