4340-2034 Screening compound: 2-{[(4-methylphenyl)methyl]sulfanyl}-1-(3,4,5-trimethoxybenzoyl)-1H-1,3-benzodiazole

4340-2034 Screening compound: 2-{[(4-methylphenyl)methyl]sulfanyl}-1-(3,4,5-trimethoxybenzoyl)-1H-1,3-benzodiazole
4340-2034 Screening compound: 2-{[(4-methylphenyl)methyl]sulfanyl}-1-(3,4,5-trimethoxybenzoyl)-1H-1,3-benzodiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 4340-2034
2-{[(4-methylphenyl)methyl]sulfanyl}-1-(3,4,5-trimethoxybenzoyl)-1H-1,3-benzodiazole

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

4340-2034

Molecular Formula

C25H24N2O4S (C25 H24 N2 O4 S)

Compound Name

2-{[(4-methylphenyl)methyl]sulfanyl}-1-(3,4,5-trimethoxybenzoyl)-1H-1,3-benzodiazole

IUPAC name

2-{[(4-methylphenyl)methyl]sulfanyl}-1-(345-trimethoxybenzoyl)-1H-13-benzodiazole

SMILES

Cc1ccc(CSc2nc(cccc3)c3n2C(c(cc2OC)cc(OC)c2OC)=O)cc1

InChI

InChI=1S/C25H24N2O4S/c1-16-9-11-17(12-10-16)15-32-25-26-19-7-5-6-8-20(19)27(25)24(28)18-13-21(29-2)23(31-4)22(14-18)30-3/h5-14H,15H2,1-4H3

InChI Key

QKVKDMCFFLISCP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02997195

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

448.54

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.783

Distribution Coefficient, logD

4.783

Water Solubility, LogSw

-4.63

Polar Surface Area

47.394

Acid Dissociation Constant (pKa)

24.63

Base Dissociation Constant (pKb)

2.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

References: we are preparing a list of scientific research reports with 4340-2034 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4340-2034?
Check Price and Availability of 4340-2034, 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 4340-2034 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4340-2034
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4340-2034
  • 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 4340-2034 available by request