C260-2429 Screening compound: 1-[2-(5-chlorothiophen-2-yl)-2-oxoethyl]-6,7-dimethoxy-3-(2-phenylethyl)-1,2,3,4-tetrahydroquinazoline-2,4-dione

C260-2429 Screening compound: 1-[2-(5-chlorothiophen-2-yl)-2-oxoethyl]-6,7-dimethoxy-3-(2-phenylethyl)-1,2,3,4-tetrahydroquinazoline-2,4-dione
C260-2429 Screening compound: 1-[2-(5-chlorothiophen-2-yl)-2-oxoethyl]-6,7-dimethoxy-3-(2-phenylethyl)-1,2,3,4-tetrahydroquinazoline-2,4-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound C260-2429
1-[2-(5-chlorothiophen-2-yl)-2-oxoethyl]-6,7-dimethoxy-3-(2-phenylethyl)-1,2,3,4-tetrahydroquinazoline-2,4-dione

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

C260-2429

Molecular Formula

C24H21ClN2O5S (C24 H21 ClN2 O5 S)

Compound Name

1-[2-(5-chlorothiophen-2-yl)-2-oxoethyl]-6,7-dimethoxy-3-(2-phenylethyl)-1,2,3,4-tetrahydroquinazoline-2,4-dione

IUPAC name

1-[2-(5-chlorothiophen-2-yl)-2-oxoethyl]-67-dimethoxy-3-(2-phenylethyl)-1234-tetrahydroquinazoline-24-dione

SMILES

COc(c(OC)c1)cc(C(N2CCc3ccccc3)=O)c1N(CC(c(s1)ccc1Cl)=O)C2=O

InChI

InChI=1S/C24H21ClN2O5S/c1-31-19-12-16-17(13-20(19)32-2)27(14-18(28)21-8-9-22(25)33-21)24(30)26(23(16)29)11-10-15-6-4-3-5-7-15/h3-9,12-13H,10-11,14H2,1-2H3

InChI Key

HRPINQRXEAWLJP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14738605

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

484.96

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.947

Distribution Coefficient, logD

4.947

Water Solubility, LogSw

-4.92

Polar Surface Area

60.771

Acid Dissociation Constant (pKa)

18.82

Base Dissociation Constant (pKb)

-8.45

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.80

C260-2429 in Drug Discovery

Included in Screening Libraries

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

New Agro Library (44492 compounds)

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

Included in 1.7M Stock Database

Agro:
  • Agro
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 C260-2429 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C260-2429?
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What is the minimum amount of C260-2429 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C260-2429
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C260-2429
  • 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 C260-2429 available by request