P572-4901 Screening compound: N-(3-ethylphenyl)-2-{7-methyl-5-[(4-methylphenyl)amino]-3-oxo-2H,3H-[1,2,4]triazolo[4,3-c]pyrimidin-2-yl}acetamide

P572-4901 Screening compound: N-(3-ethylphenyl)-2-{7-methyl-5-[(4-methylphenyl)amino]-3-oxo-2H,3H-[1,2,4]triazolo[4,3-c]pyrimidin-2-yl}acetamide
P572-4901 Screening compound: N-(3-ethylphenyl)-2-{7-methyl-5-[(4-methylphenyl)amino]-3-oxo-2H,3H-[1,2,4]triazolo[4,3-c]pyrimidin-2-yl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P572-4901
N-(3-ethylphenyl)-2-{7-methyl-5-[(4-methylphenyl)amino]-3-oxo-2H,3H-[1,2,4]triazolo[4,3-c]pyrimidin-2-yl}acetamide

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

P572-4901

Molecular Formula

C23H24N6O2 (C23 H24 N6 O2)

Compound Name

N-(3-ethylphenyl)-2-{7-methyl-5-[(4-methylphenyl)amino]-3-oxo-2H,3H-[1,2,4]triazolo[4,3-c]pyrimidin-2-yl}acetamide

IUPAC name

N-(3-ethylphenyl)-2-{7-methyl-5-[(4-methylphenyl)amino]-3-oxo-2H3H-[124]triazolo[43-c]pyrimidin-2-yl}acetamide

SMILES

CCc1cccc(NC(CN(C2=O)N=C3N2C(Nc2ccc(C)cc2)=NC(C)=C3)=O)c1

InChI

InChI=1S/C23H24N6O2/c1-4-17-6-5-7-19(13-17)25-21(30)14-28-23(31)29-20(27-28)12-16(3)24-22(29)26-18-10-8-15(2)9-11-18/h5-13H,4,14H2,1-3H3,(H,24,26)(H,25,30)

InChI Key

JJHPIFJWDUPEML-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27604569

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

416.48

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.333

Distribution Coefficient, logD

4.332

Water Solubility, LogSw

-4.27

Polar Surface Area

73.795

Acid Dissociation Constant (pKa)

10.87

Base Dissociation Constant (pKb)

2.80

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.70

P572-4901 in Drug Discovery

Included in Screening Libraries

C-Met Library (15277 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

SmartTM Library (51161 compounds)

Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Endocrine
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Cancer
  • Digestive system
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Immune system
Targets:
  • Kinases
  • Proteases
  • Others
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with P572-4901 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P572-4901?
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What is the minimum amount of P572-4901 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P572-4901
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P572-4901
  • 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 P572-4901 available by request