D481-1825 Screening compound: 1-cyclopropanecarbonyl-3-(4-methylphenyl)-1H-1,2,4-triazol-5-amine

D481-1825 Screening compound: 1-cyclopropanecarbonyl-3-(4-methylphenyl)-1H-1,2,4-triazol-5-amine
D481-1825 Screening compound: 1-cyclopropanecarbonyl-3-(4-methylphenyl)-1H-1,2,4-triazol-5-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound D481-1825
1-cyclopropanecarbonyl-3-(4-methylphenyl)-1H-1,2,4-triazol-5-amine

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

D481-1825

Molecular Formula

C13H14N4O (C13 H14 N4 O)

Compound Name

1-cyclopropanecarbonyl-3-(4-methylphenyl)-1H-1,2,4-triazol-5-amine

IUPAC name

1-cyclopropanecarbonyl-3-(4-methylphenyl)-1H-124-triazol-5-amine

SMILES

Cc(cc1)ccc1-c1nn(C(C2CC2)=O)c(N)n1

InChI

InChI=1S/C13H14N4O/c1-8-2-4-9(5-3-8)11-15-13(14)17(16-11)12(18)10-6-7-10/h2-5,10H,6-7H2,1H3,(H2,14,15,16)

InChI Key

UGDUOGWCQVIROU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27588958

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

242.28

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.204

Distribution Coefficient, logD

2.204

Water Solubility, LogSw

-2.47

Polar Surface Area

58.370

Acid Dissociation Constant (pKa)

14.32

Base Dissociation Constant (pKb)

0.45

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.80

D481-1825 in Drug Discovery

Included in Screening Libraries

Fragments Library (11262 compounds)

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Structure:
  • Fragments
Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with D481-1825 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D481-1825?
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What is the minimum amount of D481-1825 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D481-1825
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D481-1825
  • 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 D481-1825 available by request