C260-1131 Screening compound: methyl 2-(2-{3-[(4-{[(furan-2-yl)methyl]carbamoyl}phenyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-1-yl}acetamido)benzoate

C260-1131 Screening compound: methyl 2-(2-{3-[(4-{[(furan-2-yl)methyl]carbamoyl}phenyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-1-yl}acetamido)benzoate
C260-1131 Screening compound: methyl 2-(2-{3-[(4-{[(furan-2-yl)methyl]carbamoyl}phenyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-1-yl}acetamido)benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound C260-1131
methyl 2-(2-{3-[(4-{[(furan-2-yl)methyl]carbamoyl}phenyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-1-yl}acetamido)benzoate

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

C260-1131

Molecular Formula

C31H26N4O7 (C31 H26 N4 O7)

Compound Name

methyl 2-(2-{3-[(4-{[(furan-2-yl)methyl]carbamoyl}phenyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-1-yl}acetamido)benzoate

IUPAC name

methyl 2-(2-{3-[(4-{[(furan-2-yl)methyl]carbamoyl}phenyl)methyl]-24-dioxo-1234-tetrahydroquinazolin-1-yl}acetamido)benzoate

SMILES

COC(c(cccc1)c1NC(CN(c(cccc1)c1C(N1Cc(cc2)ccc2C(NCc2ccco2)=O)=O)C1=O)=O)=O

InChI

InChI=1S/C31H26N4O7/c1-41-30(39)23-8-2-4-10-25(23)33-27(36)19-34-26-11-5-3-9-24(26)29(38)35(31(34)40)18-20-12-14-21(15-13-20)28(37)32-17-22-7-6-16-42-22/h2-16H,17-19H2,1H3,(H,32,37)(H,33,36)

InChI Key

AVWKCWIDNGIJKI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14737605

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

566.57

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

3.692

Distribution Coefficient, logD

3.680

Water Solubility, LogSw

-4.02

Polar Surface Area

107.054

Acid Dissociation Constant (pKa)

8.94

Base Dissociation Constant (pKb)

-1.55

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.90

C260-1131 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with C260-1131 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C260-1131?
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What is the minimum amount of C260-1131 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C260-1131
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C260-1131
  • 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 C260-1131 available by request