V001-8500 Screening compound: benzyl 2-[({[(5-methylfuran-2-yl)methyl](2-phenylethyl)carbamoyl}methyl)(pentyl)amino]acetate

V001-8500 Screening compound: benzyl 2-[({[(5-methylfuran-2-yl)methyl](2-phenylethyl)carbamoyl}methyl)(pentyl)amino]acetate
V001-8500 Screening compound: benzyl 2-[({[(5-methylfuran-2-yl)methyl](2-phenylethyl)carbamoyl}methyl)(pentyl)amino]acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound V001-8500
benzyl 2-[({[(5-methylfuran-2-yl)methyl](2-phenylethyl)carbamoyl}methyl)(pentyl)amino]acetate

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

V001-8500

Molecular Formula

C30H38N2O4 (C30 H38 N2 O4)

Compound Name

benzyl 2-[({[(5-methylfuran-2-yl)methyl](2-phenylethyl)carbamoyl}methyl)(pentyl)amino]acetate

IUPAC name

benzyl 2-[({[(5-methylfuran-2-yl)methyl](2-phenylethyl)carbamoyl}methyl)(pentyl)amino]acetate

SMILES

CCCCCN(CC(N(CCc1ccccc1)Cc1ccc(C)o1)=O)CC(OCc1ccccc1)=O

InChI

InChI=1S/C30H38N2O4/c1-3-4-11-19-31(23-30(34)35-24-27-14-9-6-10-15-27)22-29(33)32(21-28-17-16-25(2)36-28)20-18-26-12-7-5-8-13-26/h5-10,12-17H,3-4,11,18-24H2,1-2H3

InChI Key

SMOMIDVESCNOJR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19842800

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

490.64

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

17.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.942

Distribution Coefficient, logD

5.942

Water Solubility, LogSw

-5.24

Polar Surface Area

47.388

Acid Dissociation Constant (pKa)

23.20

Base Dissociation Constant (pKb)

3.45

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

V001-8500 in Drug Discovery

Included in Screening Libraries

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with V001-8500 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V001-8500?
Check Price and Availability of V001-8500, 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 V001-8500 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V001-8500
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V001-8500
  • 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 V001-8500 available by request