V018-1005 Screening compound: N-(3-{3-[(4-methylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)-2-phenoxyacetamide

V018-1005 Screening compound: N-(3-{3-[(4-methylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)-2-phenoxyacetamide
V018-1005 Screening compound: N-(3-{3-[(4-methylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)-2-phenoxyacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V018-1005
N-(3-{3-[(4-methylphenyl)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

V018-1005

Molecular Formula

C26H27N3O3 (C26 H27 N3 O3)

Compound Name

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

IUPAC name

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

SMILES

Cc1ccc(CN(CCCN2c3cc(NC(COc4ccccc4)=O)ccc3)C2=O)cc1

InChI

InChI=1S/C26H27N3O3/c1-20-11-13-21(14-12-20)18-28-15-6-16-29(26(28)31)23-8-5-7-22(17-23)27-25(30)19-32-24-9-3-2-4-10-24/h2-5,7-14,17H,6,15-16,18-19H2,1H3,(H,27,30)

InChI Key

JHJXVKNFZXAGSH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19897061

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

429.52

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.888

Distribution Coefficient, logD

4.888

Water Solubility, LogSw

-4.53

Polar Surface Area

50.174

Acid Dissociation Constant (pKa)

11.80

Base Dissociation Constant (pKb)

2.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.10

References: we are preparing a list of scientific research reports with V018-1005 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V018-1005?
Check Price and Availability of V018-1005, 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 V018-1005 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V018-1005
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V018-1005
  • 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 V018-1005 available by request