D579-0743 Screening compound: N-(4-chlorophenyl)-2-[5-(4-methoxyphenyl)-3-oxo-2,3-dihydro-1,2,4-triazin-2-yl]butanamide

D579-0743 Screening compound: N-(4-chlorophenyl)-2-[5-(4-methoxyphenyl)-3-oxo-2,3-dihydro-1,2,4-triazin-2-yl]butanamide
D579-0743 Screening compound: N-(4-chlorophenyl)-2-[5-(4-methoxyphenyl)-3-oxo-2,3-dihydro-1,2,4-triazin-2-yl]butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D579-0743
N-(4-chlorophenyl)-2-[5-(4-methoxyphenyl)-3-oxo-2,3-dihydro-1,2,4-triazin-2-yl]butanamide

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

D579-0743

Molecular Formula

C20H19ClN4O3 (C20 H19 ClN4 O3)

Compound Name

N-(4-chlorophenyl)-2-[5-(4-methoxyphenyl)-3-oxo-2,3-dihydro-1,2,4-triazin-2-yl]butanamide

IUPAC name

N-(4-chlorophenyl)-2-[5-(4-methoxyphenyl)-3-oxo-23-dihydro-124-triazin-2-yl]butanamide

SMILES

CCC(C(Nc(cc1)ccc1Cl)=O)N1N=CC(c(cc2)ccc2OC)=NC1=O

InChI

InChI=1S/C20H19ClN4O3/c1-3-18(19(26)23-15-8-6-14(21)7-9-15)25-20(27)24-17(12-22-25)13-4-10-16(28-2)11-5-13/h4-12,18H,3H2,1-2H3,(H,23,26)/t18-/m0/s1

InChI Key

XCGCQTMXJKYHQX-SFHVURJKSA-N

MDL Number (MFCD)

MFCD14859890

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

398.85

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.192

Distribution Coefficient, logD

4.191

Water Solubility, LogSw

-4.50

Polar Surface Area

66.086

Acid Dissociation Constant (pKa)

10.84

Base Dissociation Constant (pKb)

4.79

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

20.00

D579-0743 in Drug Discovery

Included in Screening Libraries

C-Met Library (15277 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Endocrine
Targets:
  • Kinases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with D579-0743 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D579-0743?
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What is the minimum amount of D579-0743 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D579-0743
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D579-0743
  • 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 D579-0743 available by request