C260-1614 Screening compound: 4-[(1-{[(4-bromo-2-fluorophenyl)carbamoyl]methyl}-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl)methyl]-N-(3-methoxypropyl)benzamide

C260-1614 Screening compound: 4-[(1-{[(4-bromo-2-fluorophenyl)carbamoyl]methyl}-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl)methyl]-N-(3-methoxypropyl)benzamide
C260-1614 Screening compound: 4-[(1-{[(4-bromo-2-fluorophenyl)carbamoyl]methyl}-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl)methyl]-N-(3-methoxypropyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C260-1614
4-[(1-{[(4-bromo-2-fluorophenyl)carbamoyl]methyl}-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl)methyl]-N-(3-methoxypropyl)benzamide

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

C260-1614

Molecular Formula

C28H26BrFN4O5 (C28 H26 BrFN4 O5)

Compound Name

4-[(1-{[(4-bromo-2-fluorophenyl)carbamoyl]methyl}-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl)methyl]-N-(3-methoxypropyl)benzamide

IUPAC name

4-[(1-{[(4-bromo-2-fluorophenyl)carbamoyl]methyl}-24-dioxo-1234-tetrahydroquinazolin-3-yl)methyl]-N-(3-methoxypropyl)benzamide

SMILES

COCCCNC(c1ccc(CN(C(c(cccc2)c2N2CC(Nc(ccc(Br)c3)c3F)=O)=O)C2=O)cc1)=O

InChI

InChI=1S/C28H26BrFN4O5/c1-39-14-4-13-31-26(36)19-9-7-18(8-10-19)16-34-27(37)21-5-2-3-6-24(21)33(28(34)38)17-25(35)32-23-12-11-20(29)15-22(23)30/h2-3,5-12,15H,4,13-14,16-17H2,1H3,(H,31,36)(H,32,35)

InChI Key

SKXKCKSMYJGBSW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14738038

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

597.44

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.590

Distribution Coefficient, logD

3.582

Water Solubility, LogSw

-3.92

Polar Surface Area

86.587

Acid Dissociation Constant (pKa)

9.16

Base Dissociation Constant (pKb)

-1.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.40

C260-1614 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

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

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with C260-1614 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C260-1614?
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What is the minimum amount of C260-1614 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C260-1614
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C260-1614
  • 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 C260-1614 available by request