V013-0226 Screening compound: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[N-(3-ethoxypropyl)-2,2-diphenylacetamido]-N-[(thiophen-2-yl)methyl]acetamide

V013-0226 Screening compound: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[N-(3-ethoxypropyl)-2,2-diphenylacetamido]-N-[(thiophen-2-yl)methyl]acetamide
V013-0226 Screening compound: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[N-(3-ethoxypropyl)-2,2-diphenylacetamido]-N-[(thiophen-2-yl)methyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V013-0226
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[N-(3-ethoxypropyl)-2,2-diphenylacetamido]-N-[(thiophen-2-yl)methyl]acetamide

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

V013-0226

Molecular Formula

C36H42N2O5S (C36 H42 N2 O5 S)

Compound Name

N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[N-(3-ethoxypropyl)-2,2-diphenylacetamido]-N-[(thiophen-2-yl)methyl]acetamide

IUPAC name

N-[2-(34-dimethoxyphenyl)ethyl]-2-[N-(3-ethoxypropyl)-22-diphenylacetamido]-N-[(thiophen-2-yl)methyl]acetamide

SMILES

CCOCCCN(CC(N(CCc(cc1)cc(OC)c1OC)Cc1cccs1)=O)C(C(c1ccccc1)c1ccccc1)=O

InChI

InChI=1S/C36H42N2O5S/c1-4-43-23-12-21-38(36(40)35(29-13-7-5-8-14-29)30-15-9-6-10-16-30)27-34(39)37(26-31-17-11-24-44-31)22-20-28-18-19-32(41-2)33(25-28)42-3/h5-11,13-19,24-25,35H,4,12,20-23,26-27H2,1-3H3

InChI Key

BLHYXGVYDWCTCZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19767768

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

614.81

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

19.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.563

Distribution Coefficient, logD

5.563

Water Solubility, LogSw

-5.42

Polar Surface Area

56.075

Acid Dissociation Constant (pKa)

15.29

Base Dissociation Constant (pKb)

-0.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with V013-0226 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V013-0226?
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What is the minimum amount of V013-0226 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V013-0226
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V013-0226
  • 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 V013-0226 available by request