V002-1760 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(2-fluorophenyl)-3,5-dioxo-4-{[4-(trifluoromethyl)phenyl]methyl}-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide

V002-1760 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(2-fluorophenyl)-3,5-dioxo-4-{[4-(trifluoromethyl)phenyl]methyl}-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
V002-1760 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(2-fluorophenyl)-3,5-dioxo-4-{[4-(trifluoromethyl)phenyl]methyl}-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V002-1760
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(2-fluorophenyl)-3,5-dioxo-4-{[4-(trifluoromethyl)phenyl]methyl}-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide

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

V002-1760

Molecular Formula

C26H18F4N4O5 (C26 H18 F4 N4 O5)

Compound Name

N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(2-fluorophenyl)-3,5-dioxo-4-{[4-(trifluoromethyl)phenyl]methyl}-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide

IUPAC name

N-[(2H-13-benzodioxol-5-yl)methyl]-2-(2-fluorophenyl)-35-dioxo-4-{[4-(trifluoromethyl)phenyl]methyl}-2345-tetrahydro-124-triazine-6-carboxamide

SMILES

O=C(C(C(N1Cc2ccc(C(F)(F)F)cc2)=O)=NN(c(cccc2)c2F)C1=O)NCc(cc1)cc2c1OCO2

InChI

InChI=1S/C26H18F4N4O5/c27-18-3-1-2-4-19(18)34-25(37)33(13-15-5-8-17(9-6-15)26(28,29)30)24(36)22(32-34)23(35)31-12-16-7-10-20-21(11-16)39-14-38-20/h1-11H,12-14H2,(H,31,35)

InChI Key

UZFCUHYYVIPUQY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19837743

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

542.45

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.443

Distribution Coefficient, logD

4.443

Water Solubility, LogSw

-4.53

Polar Surface Area

83.473

Acid Dissociation Constant (pKa)

10.38

Base Dissociation Constant (pKb)

-1.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.40

References: we are preparing a list of scientific research reports with V002-1760 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V002-1760?
Check Price and Availability of V002-1760, 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 V002-1760 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V002-1760
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V002-1760
  • 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 V002-1760 available by request