V023-3599 Screening compound: isopropyl 4-(4-chlorophenyl)-1-(3-cyanobenzyl)-2-methyl-6-oxo-1,4,5,6-tetrahydro-3-pyridinecarboxylate

V023-3599 Screening compound: isopropyl 4-(4-chlorophenyl)-1-(3-cyanobenzyl)-2-methyl-6-oxo-1,4,5,6-tetrahydro-3-pyridinecarboxylate
V023-3599 Screening compound: isopropyl 4-(4-chlorophenyl)-1-(3-cyanobenzyl)-2-methyl-6-oxo-1,4,5,6-tetrahydro-3-pyridinecarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V023-3599
isopropyl 4-(4-chlorophenyl)-1-(3-cyanobenzyl)-2-methyl-6-oxo-1,4,5,6-tetrahydro-3-pyridinecarboxylate

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

V023-3599

Molecular Formula

C24H23ClN2O3 (C24 H23 ClN2 O3)

Compound Name

isopropyl 4-(4-chlorophenyl)-1-(3-cyanobenzyl)-2-methyl-6-oxo-1,4,5,6-tetrahydro-3-pyridinecarboxylate

IUPAC name

propan-2-yl 4-(4-chlorophenyl)-1-[(3-cyanophenyl)methyl]-2-methyl-6-oxo-1456-tetrahydropyridine-3-carboxylate

SMILES

CC(C)OC(C(C(C1)c(cc2)ccc2Cl)=C(C)N(Cc2cc(C#N)ccc2)C1=O)=O

InChI

InChI=1S/C24H23ClN2O3/c1-15(2)30-24(29)23-16(3)27(14-18-6-4-5-17(11-18)13-26)22(28)12-21(23)19-7-9-20(25)10-8-19/h4-11,15,21H,12,14H2,1-3H3/t21-/m0/s1

InChI Key

FLYREHJOBWIUPJ-NRFANRHFSA-N

MDL Number (MFCD)

MFCD19907050

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

422.91

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.560

Distribution Coefficient, logD

4.560

Water Solubility, LogSw

-4.95

Polar Surface Area

53.337

Acid Dissociation Constant (pKa)

18.86

Base Dissociation Constant (pKb)

-3.49

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

29.17

References: we are preparing a list of scientific research reports with V023-3599 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V023-3599?
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What is the minimum amount of V023-3599 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V023-3599
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V023-3599
  • 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 V023-3599 available by request