C429-0640 Screening compound: tert-butyl 4-{4-[(2,4-dimethylphenyl)carbamoyl]-1-(4-methylphenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate

C429-0640 Screening compound: tert-butyl 4-{4-[(2,4-dimethylphenyl)carbamoyl]-1-(4-methylphenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate
C429-0640 Screening compound: tert-butyl 4-{4-[(2,4-dimethylphenyl)carbamoyl]-1-(4-methylphenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound C429-0640
tert-butyl 4-{4-[(2,4-dimethylphenyl)carbamoyl]-1-(4-methylphenyl)-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

C429-0640

Molecular Formula

C29H36N4O3 (C29 H36 N4 O3)

Compound Name

tert-butyl 4-{4-[(2,4-dimethylphenyl)carbamoyl]-1-(4-methylphenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate

IUPAC name

tert-butyl 4-{4-[(24-dimethylphenyl)carbamoyl]-1-(4-methylphenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate

SMILES

CC(C)(C)OC(N(CC1)CCC1c(n(-c1ccc(C)cc1)nc1)c1C(Nc1c(C)cc(C)cc1)=O)=O

InChI

InChI=1S/C29H36N4O3/c1-19-7-10-23(11-8-19)33-26(22-13-15-32(16-14-22)28(35)36-29(4,5)6)24(18-30-33)27(34)31-25-12-9-20(2)17-21(25)3/h7-12,17-18,22H,13-16H2,1-6H3,(H,31,34)

InChI Key

PEKORYFGYPJYOG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14756245

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

488.63

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

7.053

Distribution Coefficient, logD

7.053

Water Solubility, LogSw

-5.36

Polar Surface Area

57.536

Acid Dissociation Constant (pKa)

11.11

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 C429-0640 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C429-0640?
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What is the minimum amount of C429-0640 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C429-0640
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C429-0640
  • 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 C429-0640 available by request