8020-3897 Screening compound: ethyl 4-methyl-2-{(E)-2-[(4-methylphenyl)sulfonyl]hydrazono}-6-phenyl-3-cyclohexene-1-carboxylate

8020-3897 Screening compound: ethyl 4-methyl-2-{(E)-2-[(4-methylphenyl)sulfonyl]hydrazono}-6-phenyl-3-cyclohexene-1-carboxylate
8020-3897 Screening compound: ethyl 4-methyl-2-{(E)-2-[(4-methylphenyl)sulfonyl]hydrazono}-6-phenyl-3-cyclohexene-1-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8020-3897
ethyl 4-methyl-2-{(E)-2-[(4-methylphenyl)sulfonyl]hydrazono}-6-phenyl-3-cyclohexene-1-carboxylate

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

8020-3897

Molecular Formula

C23H26N2O4S (C23 H26 N2 O4 S)

Compound Name

ethyl 4-methyl-2-{(E)-2-[(4-methylphenyl)sulfonyl]hydrazono}-6-phenyl-3-cyclohexene-1-carboxylate

IUPAC name

n/a

SMILES

CCOC(C(C(CC(C)=C1)c2ccccc2)/C1=N/NS(c1ccc(C)cc1)(=O)=O)=O

InChI

InChI=1S/C23H26N2O4S/c1-4-29-23(26)22-20(18-8-6-5-7-9-18)14-17(3)15-21(22)24-25-30(27,28)19-12-10-16(2)11-13-19/h5-13,15,20,22,25H,4,14H2,1-3H3

InChI Key

JWUIDNDIALQFIG-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

426.54

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.319

Distribution Coefficient, logD

1.809

Water Solubility, LogSw

-5.19

Polar Surface Area

70.804

Acid Dissociation Constant (pKa)

3.89

Base Dissociation Constant (pKb)

1.29

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

30.40

References: we are preparing a list of scientific research reports with 8020-3897 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8020-3897?
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What is the minimum amount of 8020-3897 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8020-3897
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8020-3897
  • 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 8020-3897 available by request