V023-4446 Screening compound: tert-butyl 4-(2-chlorophenyl)-1-(4-methoxybenzyl)-2-methyl-6-oxo-1,4,5,6-tetrahydro-3-pyridinecarboxylate

V023-4446 Screening compound: tert-butyl 4-(2-chlorophenyl)-1-(4-methoxybenzyl)-2-methyl-6-oxo-1,4,5,6-tetrahydro-3-pyridinecarboxylate
V023-4446 Screening compound: tert-butyl 4-(2-chlorophenyl)-1-(4-methoxybenzyl)-2-methyl-6-oxo-1,4,5,6-tetrahydro-3-pyridinecarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V023-4446
tert-butyl 4-(2-chlorophenyl)-1-(4-methoxybenzyl)-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

V023-4446

Molecular Formula

C25H28ClNO4 (C25 H28 ClNO4)

Compound Name

tert-butyl 4-(2-chlorophenyl)-1-(4-methoxybenzyl)-2-methyl-6-oxo-1,4,5,6-tetrahydro-3-pyridinecarboxylate

IUPAC name

tert-butyl 4-(2-chlorophenyl)-1-[(4-methoxyphenyl)methyl]-2-methyl-6-oxo-1456-tetrahydropyridine-3-carboxylate

SMILES

CC(C)(C)OC(C(C(C1)c(cccc2)c2Cl)=C(C)N(Cc(cc2)ccc2OC)C1=O)=O

InChI

InChI=1S/C25H28ClNO4/c1-16-23(24(29)31-25(2,3)4)20(19-8-6-7-9-21(19)26)14-22(28)27(16)15-17-10-12-18(30-5)13-11-17/h6-13,20H,14-15H2,1-5H3/t20-/m0/s1

InChI Key

BQAPXGZMJUIBTO-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD19907002

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

441.95

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

5.395

Distribution Coefficient, logD

5.395

Water Solubility, LogSw

-5.85

Polar Surface Area

43.255

Acid Dissociation Constant (pKa)

18.86

Base Dissociation Constant (pKb)

-3.67

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

36.00

References: we are preparing a list of scientific research reports with V023-4446 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V023-4446?
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What is the minimum amount of V023-4446 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V023-4446
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V023-4446
  • 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 V023-4446 available by request