6786-9506 Screening compound: 3,5-dimethyl 1-cyclohexyl-4-(3-methylphenyl)-1,4-dihydropyridine-3,5-dicarboxylate

6786-9506 Screening compound: 3,5-dimethyl 1-cyclohexyl-4-(3-methylphenyl)-1,4-dihydropyridine-3,5-dicarboxylate
6786-9506 Screening compound: 3,5-dimethyl 1-cyclohexyl-4-(3-methylphenyl)-1,4-dihydropyridine-3,5-dicarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 6786-9506
3,5-dimethyl 1-cyclohexyl-4-(3-methylphenyl)-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

6786-9506

Molecular Formula

C22H27NO4 (C22 H27 NO4)

Compound Name

3,5-dimethyl 1-cyclohexyl-4-(3-methylphenyl)-1,4-dihydropyridine-3,5-dicarboxylate

IUPAC name

35-dimethyl 1-cyclohexyl-4-(3-methylphenyl)-14-dihydropyridine-35-dicarboxylate

SMILES

Cc1cccc(C2C(C(OC)=O)=CN(C3CCCCC3)C=C2C(OC)=O)c1

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

369.46

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.162

Distribution Coefficient, logD

4.162

Water Solubility, LogSw

-4.23

Polar Surface Area

44.830

Acid Dissociation Constant (pKa)

28.39

Base Dissociation Constant (pKb)

0.65

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.50

6786-9506 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 6786-9506 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6786-9506?
Check Price and Availability of 6786-9506, 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 6786-9506 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6786-9506
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6786-9506
  • 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 6786-9506 available by request