V018-8023 Screening compound: 1-[5-methyl-2-(2-oxo-3-{[3-(trifluoromethoxy)phenyl]methyl}-1,3-diazinan-1-yl)phenyl]-3-phenylurea

V018-8023 Screening compound: 1-[5-methyl-2-(2-oxo-3-{[3-(trifluoromethoxy)phenyl]methyl}-1,3-diazinan-1-yl)phenyl]-3-phenylurea
V018-8023 Screening compound: 1-[5-methyl-2-(2-oxo-3-{[3-(trifluoromethoxy)phenyl]methyl}-1,3-diazinan-1-yl)phenyl]-3-phenylurea alternative view

Chemical Structure Depiction of ChemDiv screening compound V018-8023
1-[5-methyl-2-(2-oxo-3-{[3-(trifluoromethoxy)phenyl]methyl}-1,3-diazinan-1-yl)phenyl]-3-phenylurea

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

V018-8023

Molecular Formula

C26H25F3N4O3 (C26 H25 F3 N4 O3)

Compound Name

1-[5-methyl-2-(2-oxo-3-{[3-(trifluoromethoxy)phenyl]methyl}-1,3-diazinan-1-yl)phenyl]-3-phenylurea

IUPAC name

1-[5-methyl-2-(2-oxo-3-{[3-(trifluoromethoxy)phenyl]methyl}-13-diazinan-1-yl)phenyl]-3-phenylurea

SMILES

Cc(cc1)cc(NC(Nc2ccccc2)=O)c1N(CCCN1Cc2cccc(OC(F)(F)F)c2)C1=O

InChI

InChI=1S/C26H25F3N4O3/c1-18-11-12-23(22(15-18)31-24(34)30-20-8-3-2-4-9-20)33-14-6-13-32(25(33)35)17-19-7-5-10-21(16-19)36-26(27,28)29/h2-5,7-12,15-16H,6,13-14,17H2,1H3,(H2,30,31,34)

InChI Key

PUYWJPVKFODSSB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19930958

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

498.5

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

6.080

Distribution Coefficient, logD

6.080

Water Solubility, LogSw

-5.42

Polar Surface Area

57.038

Acid Dissociation Constant (pKa)

11.95

Base Dissociation Constant (pKb)

0.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.10

V018-8023 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Nucleic Acid Ligands (8311 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Infections
  • Cancer
  • Musculoskeletal
  • Nervous system
  • Hemic and lymphatic
  • Immune system

References: we are preparing a list of scientific research reports with V018-8023 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V018-8023?
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What is the minimum amount of V018-8023 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V018-8023
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V018-8023
  • 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 V018-8023 available by request