C260-2639 Screening compound: 2-{6,7-dimethoxy-2,4-dioxo-3-[(oxolan-2-yl)methyl]-1,2,3,4-tetrahydroquinazolin-1-yl}-N-(4-ethylphenyl)acetamide

C260-2639 Screening compound: 2-{6,7-dimethoxy-2,4-dioxo-3-[(oxolan-2-yl)methyl]-1,2,3,4-tetrahydroquinazolin-1-yl}-N-(4-ethylphenyl)acetamide
C260-2639 Screening compound: 2-{6,7-dimethoxy-2,4-dioxo-3-[(oxolan-2-yl)methyl]-1,2,3,4-tetrahydroquinazolin-1-yl}-N-(4-ethylphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C260-2639
2-{6,7-dimethoxy-2,4-dioxo-3-[(oxolan-2-yl)methyl]-1,2,3,4-tetrahydroquinazolin-1-yl}-N-(4-ethylphenyl)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

C260-2639

Molecular Formula

C25H29N3O6 (C25 H29 N3 O6)

Compound Name

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

IUPAC name

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

SMILES

CCc(cc1)ccc1NC(CN(c(cc(c(OC)c1)OC)c1C(N1CC2OCCC2)=O)C1=O)=O

InChI

InChI=1S/C25H29N3O6/c1-4-16-7-9-17(10-8-16)26-23(29)15-27-20-13-22(33-3)21(32-2)12-19(20)24(30)28(25(27)31)14-18-6-5-11-34-18/h7-10,12-13,18H,4-6,11,14-15H2,1-3H3,(H,26,29)/t18-/m1/s1

InChI Key

HYOBNPFMRLHNKQ-GOSISDBHSA-N

MDL Number (MFCD)

MFCD14738782

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

467.52

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.470

Distribution Coefficient, logD

3.470

Water Solubility, LogSw

-3.74

Polar Surface Area

78.331

Acid Dissociation Constant (pKa)

12.72

Base Dissociation Constant (pKb)

0.90

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.00

C260-2639 in Drug Discovery

Included in Screening Libraries

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

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C260-2639 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C260-2639?
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What is the minimum amount of C260-2639 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C260-2639
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C260-2639
  • 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 C260-2639 available by request