V022-9334 Screening compound: 2-(4-chlorophenyl)-N-[(furan-2-yl)methyl]-4-[(2-methylphenyl)methyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide

V022-9334 Screening compound: 2-(4-chlorophenyl)-N-[(furan-2-yl)methyl]-4-[(2-methylphenyl)methyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
V022-9334 Screening compound: 2-(4-chlorophenyl)-N-[(furan-2-yl)methyl]-4-[(2-methylphenyl)methyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V022-9334
2-(4-chlorophenyl)-N-[(furan-2-yl)methyl]-4-[(2-methylphenyl)methyl]-3,5-dioxo-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

V022-9334

Molecular Formula

C23H19ClN4O4 (C23 H19 ClN4 O4)

Compound Name

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

IUPAC name

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

SMILES

Cc1c(CN(C(C(C(NCc2ccco2)=O)=NN2c(cc3)ccc3Cl)=O)C2=O)cccc1

InChI

InChI=1S/C23H19ClN4O4/c1-15-5-2-3-6-16(15)14-27-22(30)20(21(29)25-13-19-7-4-12-32-19)26-28(23(27)31)18-10-8-17(24)9-11-18/h2-12H,13-14H2,1H3,(H,25,29)

InChI Key

HWNSCDCWDADFMV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD20004447

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

450.88

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.614

Distribution Coefficient, logD

4.593

Water Solubility, LogSw

-4.69

Polar Surface Area

74.407

Acid Dissociation Constant (pKa)

8.70

Base Dissociation Constant (pKb)

-2.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.00

References: we are preparing a list of scientific research reports with V022-9334 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V022-9334?
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What is the minimum amount of V022-9334 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V022-9334
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V022-9334
  • 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 V022-9334 available by request