3952-0225 Screening compound: 3,4,5-trimethoxy-N-[(3-{[(3,4,5-trimethoxyphenyl)formamido]methyl}phenyl)methyl]benzamide

3952-0225 Screening compound: 3,4,5-trimethoxy-N-[(3-{[(3,4,5-trimethoxyphenyl)formamido]methyl}phenyl)methyl]benzamide
3952-0225 Screening compound: 3,4,5-trimethoxy-N-[(3-{[(3,4,5-trimethoxyphenyl)formamido]methyl}phenyl)methyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3952-0225
3,4,5-trimethoxy-N-[(3-{[(3,4,5-trimethoxyphenyl)formamido]methyl}phenyl)methyl]benzamide

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

3952-0225

Molecular Formula

C28H32N2O8 (C28 H32 N2 O8)

Compound Name

3,4,5-trimethoxy-N-[(3-{[(3,4,5-trimethoxyphenyl)formamido]methyl}phenyl)methyl]benzamide

IUPAC name

345-trimethoxy-N-[(3-{[(345-trimethoxyphenyl)formamido]methyl}phenyl)methyl]benzamide

SMILES

COc1cc(C(NCc2cccc(CNC(c(cc3OC)cc(OC)c3OC)=O)c2)=O)cc(OC)c1OC

InChI

InChI=1S/C28H32N2O8/c1-33-21-11-19(12-22(34-2)25(21)37-5)27(31)29-15-17-8-7-9-18(10-17)16-30-28(32)20-13-23(35-3)26(38-6)24(14-20)36-4/h7-14H,15-16H2,1-6H3,(H,29,31)(H,30,32)

InChI Key

XZSDLFXSNAEORV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00977935

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

524.57

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

14.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.844

Distribution Coefficient, logD

2.844

Water Solubility, LogSw

-3.39

Polar Surface Area

95.021

Acid Dissociation Constant (pKa)

13.22

Base Dissociation Constant (pKb)

-3.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

References: we are preparing a list of scientific research reports with 3952-0225 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3952-0225?
Check Price and Availability of 3952-0225, 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 3952-0225 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3952-0225
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3952-0225
  • 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 3952-0225 available by request