8005-4162 Screening compound: 3,5-diethyl 2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate

8005-4162 Screening compound: 3,5-diethyl 2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
8005-4162 Screening compound: 3,5-diethyl 2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8005-4162
3,5-diethyl 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

8005-4162

Molecular Formula

C13H19NO4 (C13 H19 NO4)

Compound Name

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

IUPAC name

35-diethyl 26-dimethyl-14-dihydropyridine-35-dicarboxylate

SMILES

CCOC(C(C1)=C(C)NC(C)=C1C(OCC)=O)=O

InChI

InChI=1S/C13H19NO4/c1-5-17-12(15)10-7-11(13(16)18-6-2)9(4)14-8(10)3/h14H,5-7H2,1-4H3

InChI Key

LJXTYJXBORAIHX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00005951

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

253.3

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.181

Distribution Coefficient, logD

-2.633

Water Solubility, LogSw

-2.26

Polar Surface Area

52.133

Acid Dissociation Constant (pKa)

2.59

Base Dissociation Constant (pKb)

-1.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

53.80

8005-4162 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Dark Chemical Matter Library (18430 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro
Structure:
  • Pool

References: we are preparing a list of scientific research reports with 8005-4162 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8005-4162?
Check Price and Availability of 8005-4162, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 8005-4162 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8005-4162
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8005-4162
  • 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 8005-4162 available by request