C260-3002 Screening compound: 1-[2-(2H-1,3-benzodioxol-5-yl)-2-oxoethyl]-6,7-dimethoxy-3-(3-methoxyphenyl)-1,2,3,4-tetrahydroquinazoline-2,4-dione

C260-3002 Screening compound: 1-[2-(2H-1,3-benzodioxol-5-yl)-2-oxoethyl]-6,7-dimethoxy-3-(3-methoxyphenyl)-1,2,3,4-tetrahydroquinazoline-2,4-dione
C260-3002 Screening compound: 1-[2-(2H-1,3-benzodioxol-5-yl)-2-oxoethyl]-6,7-dimethoxy-3-(3-methoxyphenyl)-1,2,3,4-tetrahydroquinazoline-2,4-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound C260-3002
1-[2-(2H-1,3-benzodioxol-5-yl)-2-oxoethyl]-6,7-dimethoxy-3-(3-methoxyphenyl)-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

C260-3002

Molecular Formula

C26H22N2O8 (C26 H22 N2 O8)

Compound Name

1-[2-(2H-1,3-benzodioxol-5-yl)-2-oxoethyl]-6,7-dimethoxy-3-(3-methoxyphenyl)-1,2,3,4-tetrahydroquinazoline-2,4-dione

IUPAC name

1-[2-(2H-13-benzodioxol-5-yl)-2-oxoethyl]-67-dimethoxy-3-(3-methoxyphenyl)-1234-tetrahydroquinazoline-24-dione

SMILES

COc1cccc(N(C(c(cc(c(OC)c2)OC)c2N2CC(c(cc3)cc4c3OCO4)=O)=O)C2=O)c1

InChI

InChI=1S/C26H22N2O8/c1-32-17-6-4-5-16(10-17)28-25(30)18-11-22(33-2)23(34-3)12-19(18)27(26(28)31)13-20(29)15-7-8-21-24(9-15)36-14-35-21/h4-12H,13-14H2,1-3H3

InChI Key

UVRKLUCZUYZXLH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14739038

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

490.47

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

3.545

Distribution Coefficient, logD

3.545

Water Solubility, LogSw

-3.78

Polar Surface Area

83.822

Acid Dissociation Constant (pKa)

20.76

Base Dissociation Constant (pKb)

-7.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.20

C260-3002 in Drug Discovery

Included in Screening Libraries

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

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with C260-3002 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C260-3002?
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What is the minimum amount of C260-3002 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C260-3002
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C260-3002
  • 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 C260-3002 available by request