8011-9222 Screening compound: 3,5-diethyl 1-(2,5-dimethylphenyl)-4-(2,3,4-trimethoxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate

8011-9222 Screening compound: 3,5-diethyl 1-(2,5-dimethylphenyl)-4-(2,3,4-trimethoxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate
8011-9222 Screening compound: 3,5-diethyl 1-(2,5-dimethylphenyl)-4-(2,3,4-trimethoxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8011-9222
3,5-diethyl 1-(2,5-dimethylphenyl)-4-(2,3,4-trimethoxyphenyl)-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

8011-9222

Molecular Formula

C28H33NO7 (C28 H33 NO7)

Compound Name

3,5-diethyl 1-(2,5-dimethylphenyl)-4-(2,3,4-trimethoxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate

IUPAC name

35-diethyl 1-(25-dimethylphenyl)-4-(234-trimethoxyphenyl)-14-dihydropyridine-35-dicarboxylate

SMILES

CCOC(C(C(c(ccc(OC)c1OC)c1OC)C(C(OCC)=O)=C1)=CN1c1c(C)ccc(C)c1)=O

InChI

InChI=1S/C28H33NO7/c1-8-35-27(30)20-15-29(22-14-17(3)10-11-18(22)4)16-21(28(31)36-9-2)24(20)19-12-13-23(32-5)26(34-7)25(19)33-6/h10-16,24H,8-9H2,1-7H3

InChI Key

WCJWFKPDTJPMRO-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

495.57

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.276

Distribution Coefficient, logD

5.276

Water Solubility, LogSw

-5.24

Polar Surface Area

66.920

Acid Dissociation Constant (pKa)

28.80

Base Dissociation Constant (pKb)

0.36

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.70

References: we are preparing a list of scientific research reports with 8011-9222 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8011-9222?
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What is the minimum amount of 8011-9222 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8011-9222
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8011-9222
  • 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 8011-9222 available by request