2989-0071 Screening compound: 3,5-diethyl 4-(2,6-dichlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate

2989-0071 Screening compound: 3,5-diethyl 4-(2,6-dichlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
2989-0071 Screening compound: 3,5-diethyl 4-(2,6-dichlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 2989-0071
3,5-diethyl 4-(2,6-dichlorophenyl)-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

2989-0071

Molecular Formula

C19H21Cl2NO4 (C19 H21 Cl2 NO4)

Compound Name

3,5-diethyl 4-(2,6-dichlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate

IUPAC name

35-diethyl 4-(26-dichlorophenyl)-26-dimethyl-14-dihydropyridine-35-dicarboxylate

SMILES

CCOC(C(C1c(c(Cl)ccc2)c2Cl)=C(C)NC(C)=C1C(OCC)=O)=O

InChI

InChI=1S/C19H21Cl2NO4/c1-5-25-18(23)14-10(3)22-11(4)15(19(24)26-6-2)17(14)16-12(20)8-7-9-13(16)21/h7-9,17,22H,5-6H2,1-4H3

InChI Key

RRLSXWOPNTVBKD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00563629

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

398.29

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.050

Distribution Coefficient, logD

0.248

Water Solubility, LogSw

-4.15

Polar Surface Area

51.861

Acid Dissociation Constant (pKa)

3.60

Base Dissociation Constant (pKb)

-2.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.80

References: we are preparing a list of scientific research reports with 2989-0071 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2989-0071?
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What is the minimum amount of 2989-0071 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2989-0071
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2989-0071
  • 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 2989-0071 available by request