V007-7166 Screening compound: 3-(3-methoxyphenyl)-1-(5-methyl-2-{3-[(4-methylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)urea

V007-7166 Screening compound: 3-(3-methoxyphenyl)-1-(5-methyl-2-{3-[(4-methylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)urea
V007-7166 Screening compound: 3-(3-methoxyphenyl)-1-(5-methyl-2-{3-[(4-methylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound V007-7166
3-(3-methoxyphenyl)-1-(5-methyl-2-{3-[(4-methylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)urea

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

V007-7166

Molecular Formula

C27H30N4O3 (C27 H30 N4 O3)

Compound Name

3-(3-methoxyphenyl)-1-(5-methyl-2-{3-[(4-methylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)urea

IUPAC name

3-(3-methoxyphenyl)-1-(5-methyl-2-{3-[(4-methylphenyl)methyl]-2-oxo-13-diazinan-1-yl}phenyl)urea

SMILES

Cc1ccc(CN(CCCN2c(ccc(C)c3)c3NC(Nc3cc(OC)ccc3)=O)C2=O)cc1

InChI

InChI=1S/C27H30N4O3/c1-19-8-11-21(12-9-19)18-30-14-5-15-31(27(30)33)25-13-10-20(2)16-24(25)29-26(32)28-22-6-4-7-23(17-22)34-3/h4,6-13,16-17H,5,14-15,18H2,1-3H3,(H2,28,29,32)

InChI Key

XSICQHAYBTUUGX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19930916

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

458.56

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.582

Distribution Coefficient, logD

5.582

Water Solubility, LogSw

-5.27

Polar Surface Area

58.645

Acid Dissociation Constant (pKa)

12.26

Base Dissociation Constant (pKb)

0.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.90

V007-7166 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Digestive system
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with V007-7166 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V007-7166?
Check Price and Availability of V007-7166, 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 V007-7166 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V007-7166
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V007-7166
  • 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 V007-7166 available by request