G674-0711 Screening compound: 2-(4-chlorophenyl)-N-({1-[(3-fluorophenyl)methyl]piperidin-4-yl}methyl)-4-methyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide

G674-0711 Screening compound: 2-(4-chlorophenyl)-N-({1-[(3-fluorophenyl)methyl]piperidin-4-yl}methyl)-4-methyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
G674-0711 Screening compound: 2-(4-chlorophenyl)-N-({1-[(3-fluorophenyl)methyl]piperidin-4-yl}methyl)-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 G674-0711
2-(4-chlorophenyl)-N-({1-[(3-fluorophenyl)methyl]piperidin-4-yl}methyl)-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

G674-0711

Molecular Formula

C24H25ClFN5O3 (C24 H25 ClFN5 O3)

Compound Name

2-(4-chlorophenyl)-N-({1-[(3-fluorophenyl)methyl]piperidin-4-yl}methyl)-4-methyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide

IUPAC name

2-(4-chlorophenyl)-N-({1-[(3-fluorophenyl)methyl]piperidin-4-yl}methyl)-4-methyl-35-dioxo-2345-tetrahydro-124-triazine-6-carboxamide

SMILES

CN(C(C(C(NCC1CCN(Cc2cc(F)ccc2)CC1)=O)=NN1c(cc2)ccc2Cl)=O)C1=O

InChI

InChI=1S/C24H25ClFN5O3/c1-29-23(33)21(28-31(24(29)34)20-7-5-18(25)6-8-20)22(32)27-14-16-9-11-30(12-10-16)15-17-3-2-4-19(26)13-17/h2-8,13,16H,9-12,14-15H2,1H3,(H,27,32)

InChI Key

SXPXTQMVTCEJQE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27150708

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

485.95

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

3.498

Distribution Coefficient, logD

1.575

Water Solubility, LogSw

-4.01

Polar Surface Area

70.428

Acid Dissociation Constant (pKa)

10.21

Base Dissociation Constant (pKb)

9.32

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

G674-0711 in Drug Discovery

Included in Screening Libraries

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

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with G674-0711 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G674-0711?
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What is the minimum amount of G674-0711 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G674-0711
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G674-0711
  • 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 G674-0711 available by request