D481-2228 Screening compound: 1-(3,4-dimethoxybenzoyl)-3-(3,4-dimethylphenyl)-1H-1,2,4-triazol-5-amine

D481-2228 Screening compound: 1-(3,4-dimethoxybenzoyl)-3-(3,4-dimethylphenyl)-1H-1,2,4-triazol-5-amine
D481-2228 Screening compound: 1-(3,4-dimethoxybenzoyl)-3-(3,4-dimethylphenyl)-1H-1,2,4-triazol-5-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound D481-2228
1-(3,4-dimethoxybenzoyl)-3-(3,4-dimethylphenyl)-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

D481-2228

Molecular Formula

C19H20N4O3 (C19 H20 N4 O3)

Compound Name

1-(3,4-dimethoxybenzoyl)-3-(3,4-dimethylphenyl)-1H-1,2,4-triazol-5-amine

IUPAC name

1-(34-dimethoxybenzoyl)-3-(34-dimethylphenyl)-1H-124-triazol-5-amine

SMILES

Cc(cc1)c(C)cc1-c1nn(C(c(cc2)cc(OC)c2OC)=O)c(N)n1

InChI

InChI=1S/C19H20N4O3/c1-11-5-6-13(9-12(11)2)17-21-19(20)23(22-17)18(24)14-7-8-15(25-3)16(10-14)26-4/h5-10H,1-4H3,(H2,20,21,22)

InChI Key

FZITZVILSKMBPM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27589016

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

352.39

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.132

Distribution Coefficient, logD

3.132

Water Solubility, LogSw

-3.06

Polar Surface Area

73.108

Acid Dissociation Constant (pKa)

19.63

Base Dissociation Constant (pKb)

-0.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

D481-2228 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Therapeutical Diversity Annotated Library (7563 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with D481-2228 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D481-2228?
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What is the minimum amount of D481-2228 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D481-2228
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D481-2228
  • 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 D481-2228 available by request