V022-9384 Screening compound: 2-(4-methylphenyl)-4-[(2-methylphenyl)methyl]-3,5-dioxo-N-[2-(pyridin-2-yl)ethyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide

V022-9384 Screening compound: 2-(4-methylphenyl)-4-[(2-methylphenyl)methyl]-3,5-dioxo-N-[2-(pyridin-2-yl)ethyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
V022-9384 Screening compound: 2-(4-methylphenyl)-4-[(2-methylphenyl)methyl]-3,5-dioxo-N-[2-(pyridin-2-yl)ethyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V022-9384
2-(4-methylphenyl)-4-[(2-methylphenyl)methyl]-3,5-dioxo-N-[2-(pyridin-2-yl)ethyl]-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

V022-9384

Molecular Formula

C26H25N5O3 (C26 H25 N5 O3)

Compound Name

2-(4-methylphenyl)-4-[(2-methylphenyl)methyl]-3,5-dioxo-N-[2-(pyridin-2-yl)ethyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide

IUPAC name

2-(4-methylphenyl)-4-[(2-methylphenyl)methyl]-35-dioxo-N-[2-(pyridin-2-yl)ethyl]-2345-tetrahydro-124-triazine-6-carboxamide

SMILES

Cc(cc1)ccc1N(C(N1Cc2c(C)cccc2)=O)N=C(C(NCCc2ncccc2)=O)C1=O

InChI

InChI=1S/C26H25N5O3/c1-18-10-12-22(13-11-18)31-26(34)30(17-20-8-4-3-7-19(20)2)25(33)23(29-31)24(32)28-16-14-21-9-5-6-15-27-21/h3-13,15H,14,16-17H2,1-2H3,(H,28,32)

InChI Key

CZFLAIWOKKFPCH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD20004534

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

455.52

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.718

Distribution Coefficient, logD

3.717

Water Solubility, LogSw

-3.75

Polar Surface Area

76.043

Acid Dissociation Constant (pKa)

10.38

Base Dissociation Constant (pKb)

4.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.20

References: we are preparing a list of scientific research reports with V022-9384 chemical compound. It will be published here after verification.

Frequently Asked Questions

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Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V022-9384
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V022-9384
  • 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 V022-9384 available by request