V006-9560 Screening compound: methyl 3-{[(3-methoxypropyl)({[(5-methylfuran-2-yl)methyl](2-phenylethyl)carbamoyl}methyl)amino]methyl}benzoate

V006-9560 Screening compound: methyl 3-{[(3-methoxypropyl)({[(5-methylfuran-2-yl)methyl](2-phenylethyl)carbamoyl}methyl)amino]methyl}benzoate
V006-9560 Screening compound: methyl 3-{[(3-methoxypropyl)({[(5-methylfuran-2-yl)methyl](2-phenylethyl)carbamoyl}methyl)amino]methyl}benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound V006-9560
methyl 3-{[(3-methoxypropyl)({[(5-methylfuran-2-yl)methyl](2-phenylethyl)carbamoyl}methyl)amino]methyl}benzoate

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

V006-9560

Molecular Formula

C29H36N2O5 (C29 H36 N2 O5)

Compound Name

methyl 3-{[(3-methoxypropyl)({[(5-methylfuran-2-yl)methyl](2-phenylethyl)carbamoyl}methyl)amino]methyl}benzoate

IUPAC name

methyl 3-{[(3-methoxypropyl)({[(5-methylfuran-2-yl)methyl](2-phenylethyl)carbamoyl}methyl)amino]methyl}benzoate

SMILES

Cc1ccc(CN(CCc2ccccc2)C(CN(CCCOC)Cc2cccc(C(OC)=O)c2)=O)o1

InChI

InChI=1S/C29H36N2O5/c1-23-13-14-27(36-23)21-31(17-15-24-9-5-4-6-10-24)28(32)22-30(16-8-18-34-2)20-25-11-7-12-26(19-25)29(33)35-3/h4-7,9-14,19H,8,15-18,20-22H2,1-3H3

InChI Key

JWWYVWQKZCTIHZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19842707

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

492.62

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

16.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.335

Distribution Coefficient, logD

4.335

Water Solubility, LogSw

-4.31

Polar Surface Area

56.370

Acid Dissociation Constant (pKa)

22.53

Base Dissociation Constant (pKb)

4.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.90

V006-9560 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 V006-9560 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V006-9560?
Check Price and Availability of V006-9560, 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 V006-9560 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V006-9560
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V006-9560
  • 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 V006-9560 available by request