V011-0296 Screening compound: N~1~-(2-{(4-fluorobenzyl)[(3-methyl-2-thienyl)methyl]amino}-2-oxoethyl)-2,4-dimethoxy-N~1~-(2-methoxyethyl)benzamide

V011-0296 Screening compound: N~1~-(2-{(4-fluorobenzyl)[(3-methyl-2-thienyl)methyl]amino}-2-oxoethyl)-2,4-dimethoxy-N~1~-(2-methoxyethyl)benzamide
V011-0296 Screening compound: N~1~-(2-{(4-fluorobenzyl)[(3-methyl-2-thienyl)methyl]amino}-2-oxoethyl)-2,4-dimethoxy-N~1~-(2-methoxyethyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V011-0296
N~1~-(2-{(4-fluorobenzyl)[(3-methyl-2-thienyl)methyl]amino}-2-oxoethyl)-2,4-dimethoxy-N~1~-(2-methoxyethyl)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

V011-0296

Molecular Formula

C27H31FN2O5S (C27 H31 FN2 O5 S)

Compound Name

N~1~-(2-{(4-fluorobenzyl)[(3-methyl-2-thienyl)methyl]amino}-2-oxoethyl)-2,4-dimethoxy-N~1~-(2-methoxyethyl)benzamide

IUPAC name

2-[1-(24-dimethoxyphenyl)-N-(2-methoxyethyl)formamido]-N-[(4-fluorophenyl)methyl]-N-[(3-methylthiophen-2-yl)methyl]acetamide

SMILES

Cc1c(CN(Cc(cc2)ccc2F)C(CN(CCOC)C(c(ccc(OC)c2)c2OC)=O)=O)scc1

InChI

InChI=1S/C27H31FN2O5S/c1-19-11-14-36-25(19)17-30(16-20-5-7-21(28)8-6-20)26(31)18-29(12-13-33-2)27(32)23-10-9-22(34-3)15-24(23)35-4/h5-11,14-15H,12-13,16-18H2,1-4H3

InChI Key

PRRUDZNSSUNWHT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19753493

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

514.62

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

14.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.819

Distribution Coefficient, logD

3.819

Water Solubility, LogSw

-3.96

Polar Surface Area

56.646

Acid Dissociation Constant (pKa)

21.89

Base Dissociation Constant (pKb)

-2.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.33

V011-0296 in Drug Discovery

Included in Screening Libraries

SH2 Library (10483 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Endocrine
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with V011-0296 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V011-0296?
Check Price and Availability of V011-0296, 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 V011-0296 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V011-0296
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V011-0296
  • 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 V011-0296 available by request