C260-3035 Screening compound: 2-{3-[(2-chlorophenyl)methyl]-6,7-dimethoxy-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-1-yl}-N-[(4-methylphenyl)methyl]acetamide

C260-3035 Screening compound: 2-{3-[(2-chlorophenyl)methyl]-6,7-dimethoxy-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-1-yl}-N-[(4-methylphenyl)methyl]acetamide
C260-3035 Screening compound: 2-{3-[(2-chlorophenyl)methyl]-6,7-dimethoxy-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-1-yl}-N-[(4-methylphenyl)methyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C260-3035
2-{3-[(2-chlorophenyl)methyl]-6,7-dimethoxy-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-1-yl}-N-[(4-methylphenyl)methyl]acetamide

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

C260-3035

Molecular Formula

C27H26ClN3O5 (C27 H26 ClN3 O5)

Compound Name

2-{3-[(2-chlorophenyl)methyl]-6,7-dimethoxy-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-1-yl}-N-[(4-methylphenyl)methyl]acetamide

IUPAC name

2-{3-[(2-chlorophenyl)methyl]-67-dimethoxy-24-dioxo-1234-tetrahydroquinazolin-1-yl}-N-[(4-methylphenyl)methyl]acetamide

SMILES

Cc1ccc(CNC(CN(c(cc(c(OC)c2)OC)c2C(N2Cc(cccc3)c3Cl)=O)C2=O)=O)cc1

InChI

InChI=1S/C27H26ClN3O5/c1-17-8-10-18(11-9-17)14-29-25(32)16-30-22-13-24(36-3)23(35-2)12-20(22)26(33)31(27(30)34)15-19-6-4-5-7-21(19)28/h4-13H,14-16H2,1-3H3,(H,29,32)

InChI Key

GFUWRHWYUHFZBE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14739066

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

507.97

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.583

Distribution Coefficient, logD

4.583

Water Solubility, LogSw

-4.70

Polar Surface Area

70.999

Acid Dissociation Constant (pKa)

13.33

Base Dissociation Constant (pKb)

-0.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

C260-3035 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 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 C260-3035 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C260-3035?
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What is the minimum amount of C260-3035 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C260-3035
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C260-3035
  • 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 C260-3035 available by request