C736-0501 Screening compound: 2-[2-(2-methyl-1H-1,3-benzodiazol-1-yl)ethyl]-N-[2-(3-methylphenyl)ethyl]-[1,2,4]triazolo[1,5-c]quinazolin-5-amine

C736-0501 Screening compound: 2-[2-(2-methyl-1H-1,3-benzodiazol-1-yl)ethyl]-N-[2-(3-methylphenyl)ethyl]-[1,2,4]triazolo[1,5-c]quinazolin-5-amine
C736-0501 Screening compound: 2-[2-(2-methyl-1H-1,3-benzodiazol-1-yl)ethyl]-N-[2-(3-methylphenyl)ethyl]-[1,2,4]triazolo[1,5-c]quinazolin-5-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound C736-0501
2-[2-(2-methyl-1H-1,3-benzodiazol-1-yl)ethyl]-N-[2-(3-methylphenyl)ethyl]-[1,2,4]triazolo[1,5-c]quinazolin-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

C736-0501

Molecular Formula

C28H27N7 (C28 H27 N7)

Compound Name

2-[2-(2-methyl-1H-1,3-benzodiazol-1-yl)ethyl]-N-[2-(3-methylphenyl)ethyl]-[1,2,4]triazolo[1,5-c]quinazolin-5-amine

IUPAC name

2-[2-(2-methyl-1H-13-benzodiazol-1-yl)ethyl]-N-[2-(3-methylphenyl)ethyl]-[124]triazolo[15-c]quinazolin-5-amine

SMILES

Cc1nc(cccc2)c2n1CCc1nn2c(NCCc3cc(C)ccc3)nc(cccc3)c3c2n1

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

461.57

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.297

Distribution Coefficient, logD

3.936

Water Solubility, LogSw

-5.70

Polar Surface Area

53.416

Acid Dissociation Constant (pKa)

18.39

Base Dissociation Constant (pKb)

8.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.40

C736-0501 in Drug Discovery

Included in Screening Libraries

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

CNS Targets (44014 compounds)

PI3K-Targeted Library (17255 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with C736-0501 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C736-0501?
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What is the minimum amount of C736-0501 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C736-0501
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C736-0501
  • 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 C736-0501 available by request