G674-1526 Screening compound: 2-(4-fluorophenyl)-6-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-4-methyl-2,3,4,5-tetrahydro-1,2,4-triazine-3,5-dione

G674-1526 Screening compound: 2-(4-fluorophenyl)-6-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-4-methyl-2,3,4,5-tetrahydro-1,2,4-triazine-3,5-dione
G674-1526 Screening compound: 2-(4-fluorophenyl)-6-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-4-methyl-2,3,4,5-tetrahydro-1,2,4-triazine-3,5-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound G674-1526
2-(4-fluorophenyl)-6-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-4-methyl-2,3,4,5-tetrahydro-1,2,4-triazine-3,5-dione

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

G674-1526

Molecular Formula

C22H22FN5O4 (C22 H22 FN5 O4)

Compound Name

2-(4-fluorophenyl)-6-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-4-methyl-2,3,4,5-tetrahydro-1,2,4-triazine-3,5-dione

IUPAC name

2-(4-fluorophenyl)-6-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-4-methyl-2345-tetrahydro-124-triazine-35-dione

SMILES

CN(C(C(C(N(CC1)CCN1c(cccc1)c1OC)=O)=NN1c(cc2)ccc2F)=O)C1=O

InChI

InChI=1S/C22H22FN5O4/c1-25-20(29)19(24-28(22(25)31)16-9-7-15(23)8-10-16)21(30)27-13-11-26(12-14-27)17-5-3-4-6-18(17)32-2/h3-10H,11-14H2,1-2H3

InChI Key

NUTDNZKXAXQYBM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27150796

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

439.45

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.411

Distribution Coefficient, logD

2.411

Water Solubility, LogSw

-2.46

Polar Surface Area

69.520

Acid Dissociation Constant (pKa)

28.55

Base Dissociation Constant (pKb)

3.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

G674-1526 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G674-1526 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of G674-1526 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G674-1526
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G674-1526
  • 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 G674-1526 available by request