G674-1553 Screening compound: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(4-fluorophenyl)-4-methyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide

G674-1553 Screening compound: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(4-fluorophenyl)-4-methyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
G674-1553 Screening compound: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(4-fluorophenyl)-4-methyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G674-1553
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(4-fluorophenyl)-4-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

G674-1553

Molecular Formula

C21H21FN4O5 (C21 H21 FN4 O5)

Compound Name

N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(4-fluorophenyl)-4-methyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide

IUPAC name

N-[2-(34-dimethoxyphenyl)ethyl]-2-(4-fluorophenyl)-4-methyl-35-dioxo-2345-tetrahydro-124-triazine-6-carboxamide

SMILES

CN(C(C(C(NCCc(cc1)cc(OC)c1OC)=O)=NN1c(cc2)ccc2F)=O)C1=O

InChI

InChI=1S/C21H21FN4O5/c1-25-20(28)18(24-26(21(25)29)15-7-5-14(22)6-8-15)19(27)23-11-10-13-4-9-16(30-2)17(12-13)31-3/h4-9,12H,10-11H2,1-3H3,(H,23,27)

InChI Key

ZWYXUDYQAYRSBY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27150806

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

428.42

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

1.638

Distribution Coefficient, logD

1.637

Water Solubility, LogSw

-2.29

Polar Surface Area

81.798

Acid Dissociation Constant (pKa)

9.99

Base Dissociation Constant (pKb)

-1.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

G674-1553 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with G674-1553 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of G674-1553 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G674-1553
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G674-1553
  • 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 G674-1553 available by request