C430-0923 Screening compound: tert-butyl 4-[1-(3-chloro-2-methylphenyl)-4-(ethoxycarbonyl)-1H-pyrazol-5-yl]piperidine-1-carboxylate

C430-0923 Screening compound: tert-butyl 4-[1-(3-chloro-2-methylphenyl)-4-(ethoxycarbonyl)-1H-pyrazol-5-yl]piperidine-1-carboxylate
C430-0923 Screening compound: tert-butyl 4-[1-(3-chloro-2-methylphenyl)-4-(ethoxycarbonyl)-1H-pyrazol-5-yl]piperidine-1-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound C430-0923
tert-butyl 4-[1-(3-chloro-2-methylphenyl)-4-(ethoxycarbonyl)-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

C430-0923

Molecular Formula

C23H30ClN3O4 (C23 H30 ClN3 O4)

Compound Name

tert-butyl 4-[1-(3-chloro-2-methylphenyl)-4-(ethoxycarbonyl)-1H-pyrazol-5-yl]piperidine-1-carboxylate

IUPAC name

tert-butyl 4-[1-(3-chloro-2-methylphenyl)-4-(ethoxycarbonyl)-1H-pyrazol-5-yl]piperidine-1-carboxylate

SMILES

CCOC(c1c(C(CC2)CCN2C(OC(C)(C)C)=O)n(-c2cccc(Cl)c2C)nc1)=O

InChI

InChI=1S/C23H30ClN3O4/c1-6-30-21(28)17-14-25-27(19-9-7-8-18(24)15(19)2)20(17)16-10-12-26(13-11-16)22(29)31-23(3,4)5/h7-9,14,16H,6,10-13H2,1-5H3

InChI Key

ITGDUGWXJTZULT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14756667

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

447.96

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

6.513

Distribution Coefficient, logD

6.513

Water Solubility, LogSw

-6.11

Polar Surface Area

55.596

Acid Dissociation Constant (pKa)

21.63

Base Dissociation Constant (pKb)

1.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

52.20

References: we are preparing a list of scientific research reports with C430-0923 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C430-0923?
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What is the minimum amount of C430-0923 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C430-0923
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C430-0923
  • 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 C430-0923 available by request