V028-8466 Screening compound: N-(5-methoxy-2-{3-[(4-methoxyphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)-2-phenoxyacetamide

V028-8466 Screening compound: N-(5-methoxy-2-{3-[(4-methoxyphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)-2-phenoxyacetamide
V028-8466 Screening compound: N-(5-methoxy-2-{3-[(4-methoxyphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)-2-phenoxyacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V028-8466
N-(5-methoxy-2-{3-[(4-methoxyphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)-2-phenoxyacetamide

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

V028-8466

Molecular Formula

C27H29N3O5 (C27 H29 N3 O5)

Compound Name

N-(5-methoxy-2-{3-[(4-methoxyphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)-2-phenoxyacetamide

IUPAC name

N-(5-methoxy-2-{3-[(4-methoxyphenyl)methyl]-2-oxo-13-diazinan-1-yl}phenyl)-2-phenoxyacetamide

SMILES

COc1ccc(CN(CCCN2c(ccc(OC)c3)c3NC(COc3ccccc3)=O)C2=O)cc1

InChI

InChI=1S/C27H29N3O5/c1-33-21-11-9-20(10-12-21)18-29-15-6-16-30(27(29)32)25-14-13-23(34-2)17-24(25)28-26(31)19-35-22-7-4-3-5-8-22/h3-5,7-14,17H,6,15-16,18-19H2,1-2H3,(H,28,31)

InChI Key

AOGDANWVYRLFKM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19931711

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

475.54

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.276

Distribution Coefficient, logD

4.274

Water Solubility, LogSw

-4.22

Polar Surface Area

64.263

Acid Dissociation Constant (pKa)

9.83

Base Dissociation Constant (pKb)

0.58

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.90

V028-8466 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with V028-8466 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V028-8466?
Check Price and Availability of V028-8466, 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 V028-8466 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V028-8466
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V028-8466
  • 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 V028-8466 available by request