3215-2166 Screening compound: 3,5-dibenzyl 4-[3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate

3215-2166 Screening compound: 3,5-dibenzyl 4-[3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
3215-2166 Screening compound: 3,5-dibenzyl 4-[3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 3215-2166
3,5-dibenzyl 4-[3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate

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

3215-2166

Molecular Formula

C38H32ClN3O4 (C38 H32 ClN3 O4)

Compound Name

3,5-dibenzyl 4-[3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate

IUPAC name

35-dibenzyl 4-[3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-4-yl]-26-dimethyl-14-dihydropyridine-35-dicarboxylate

SMILES

CC(NC(C)=C(C1c2cn(-c3ccccc3)nc2-c(cc2)ccc2Cl)C(OCc2ccccc2)=O)=C1C(OCc1ccccc1)=O

InChI

InChI=1S/C38H32ClN3O4/c1-25-33(37(43)45-23-27-12-6-3-7-13-27)35(34(26(2)40-25)38(44)46-24-28-14-8-4-9-15-28)32-22-42(31-16-10-5-11-17-31)41-36(32)29-18-20-30(39)21-19-29/h3-22,35,40H,23-24H2,1-2H3

InChI Key

JONMIMRRHOPVQV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01794331

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

630.14

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

7.911

Distribution Coefficient, logD

4.377

Water Solubility, LogSw

-6.44

Polar Surface Area

66.702

Acid Dissociation Constant (pKa)

3.87

Base Dissociation Constant (pKb)

-1.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.20

References: we are preparing a list of scientific research reports with 3215-2166 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3215-2166?
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What is the minimum amount of 3215-2166 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3215-2166
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3215-2166
  • 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 3215-2166 available by request