3671-5801 Screening compound: 3,5-diethyl 4-(3,4-dichlorophenyl)-1-(4-ethoxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate

3671-5801 Screening compound: 3,5-diethyl 4-(3,4-dichlorophenyl)-1-(4-ethoxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate
3671-5801 Screening compound: 3,5-diethyl 4-(3,4-dichlorophenyl)-1-(4-ethoxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 3671-5801
3,5-diethyl 4-(3,4-dichlorophenyl)-1-(4-ethoxyphenyl)-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

3671-5801

Molecular Formula

C25H25Cl2NO5 (C25 H25 Cl2 NO5)

Compound Name

3,5-diethyl 4-(3,4-dichlorophenyl)-1-(4-ethoxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate

IUPAC name

35-diethyl 4-(34-dichlorophenyl)-1-(4-ethoxyphenyl)-14-dihydropyridine-35-dicarboxylate

SMILES

CCOC(C(C(c(cc1)cc(Cl)c1Cl)C(C(OCC)=O)=C1)=CN1c(cc1)ccc1OCC)=O

InChI

InChI=1S/C25H25Cl2NO5/c1-4-31-18-10-8-17(9-11-18)28-14-19(24(29)32-5-2)23(20(15-28)25(30)33-6-3)16-7-12-21(26)22(27)13-16/h7-15,23H,4-6H2,1-3H3

InChI Key

VDIRFPCACJJHEU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02104966

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

490.38

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.192

Distribution Coefficient, logD

6.192

Water Solubility, LogSw

-6.37

Polar Surface Area

51.280

Acid Dissociation Constant (pKa)

29.18

Base Dissociation Constant (pKb)

1.40

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.00

References: we are preparing a list of scientific research reports with 3671-5801 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3671-5801?
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What is the minimum amount of 3671-5801 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3671-5801
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3671-5801
  • 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 3671-5801 available by request