C109-0759 Screening compound: 6-bromo-N-(2,3-dimethylcyclohexyl)-4-hydroxy-2-oxo-3-phenyl-1,2,3,4-tetrahydroquinazoline-4-carboxamide

C109-0759 Screening compound: 6-bromo-N-(2,3-dimethylcyclohexyl)-4-hydroxy-2-oxo-3-phenyl-1,2,3,4-tetrahydroquinazoline-4-carboxamide
C109-0759 Screening compound: 6-bromo-N-(2,3-dimethylcyclohexyl)-4-hydroxy-2-oxo-3-phenyl-1,2,3,4-tetrahydroquinazoline-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C109-0759
6-bromo-N-(2,3-dimethylcyclohexyl)-4-hydroxy-2-oxo-3-phenyl-1,2,3,4-tetrahydroquinazoline-4-carboxamide

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

C109-0759

Molecular Formula

C23H26BrN3O3 (C23 H26 BrN3 O3)

Compound Name

6-bromo-N-(2,3-dimethylcyclohexyl)-4-hydroxy-2-oxo-3-phenyl-1,2,3,4-tetrahydroquinazoline-4-carboxamide

IUPAC name

6-bromo-N-(23-dimethylcyclohexyl)-4-hydroxy-2-oxo-3-phenyl-1234-tetrahydroquinazoline-4-carboxamide

SMILES

CC(CCC1)C(C)C1NC(C(c(cc(cc1)Br)c1N1)(N(c2ccccc2)C1=O)O)=O

InChI

InChI=1S/C23H26BrN3O3/c1-14-7-6-10-19(15(14)2)25-21(28)23(30)18-13-16(24)11-12-20(18)26-22(29)27(23)17-8-4-3-5-9-17/h3-5,8-9,11-15,19,30H,6-7,10H2,1-2H3,(H,25,28)(H,26,29)

InChI Key

QHGNGGQDXGNVDJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14720256

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

472.38

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.526

Distribution Coefficient, logD

4.526

Water Solubility, LogSw

-4.20

Polar Surface Area

67.220

Acid Dissociation Constant (pKa)

12.27

Base Dissociation Constant (pKb)

3.09

Number of Chiral Centers

4.00

Percent sp3 carbon bonding

39.10

C109-0759 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with C109-0759 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C109-0759?
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What is the minimum amount of C109-0759 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C109-0759
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C109-0759
  • 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 C109-0759 available by request