G612-0637 Screening compound: tert-butyl 4-{4-[(3-acetylphenyl)carbamoyl]-1-(3-chloro-2-methylphenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate

G612-0637 Screening compound: tert-butyl 4-{4-[(3-acetylphenyl)carbamoyl]-1-(3-chloro-2-methylphenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate
G612-0637 Screening compound: tert-butyl 4-{4-[(3-acetylphenyl)carbamoyl]-1-(3-chloro-2-methylphenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound G612-0637
tert-butyl 4-{4-[(3-acetylphenyl)carbamoyl]-1-(3-chloro-2-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

G612-0637

Molecular Formula

C29H33ClN4O4 (C29 H33 ClN4 O4)

Compound Name

tert-butyl 4-{4-[(3-acetylphenyl)carbamoyl]-1-(3-chloro-2-methylphenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate

IUPAC name

tert-butyl 4-{4-[(3-acetylphenyl)carbamoyl]-1-(3-chloro-2-methylphenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate

SMILES

CC(C)(C)OC(N(CC1)CCC1c(n(-c1cccc(Cl)c1C)nc1)c1C(Nc1cc(C(C)=O)ccc1)=O)=O

InChI

InChI=1S/C29H33ClN4O4/c1-18-24(30)10-7-11-25(18)34-26(20-12-14-33(15-13-20)28(37)38-29(3,4)5)23(17-31-34)27(36)32-22-9-6-8-21(16-22)19(2)35/h6-11,16-17,20H,12-15H2,1-5H3,(H,32,36)

InChI Key

XCKBKPXGUQFNHY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15022911

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

537.06

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

6.722

Distribution Coefficient, logD

6.720

Water Solubility, LogSw

-6.25

Polar Surface Area

71.760

Acid Dissociation Constant (pKa)

9.75

Base Dissociation Constant (pKb)

1.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.90

References: we are preparing a list of scientific research reports with G612-0637 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G612-0637?
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What is the minimum amount of G612-0637 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G612-0637
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G612-0637
  • 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 G612-0637 available by request