3643-1625 Screening compound: (2E)-3-(2,5-dimethoxyphenyl)-2-(4-oxo-3,4-dihydroquinazolin-2-yl)prop-2-enenitrile

3643-1625 Screening compound: (2E)-3-(2,5-dimethoxyphenyl)-2-(4-oxo-3,4-dihydroquinazolin-2-yl)prop-2-enenitrile
3643-1625 Screening compound: (2E)-3-(2,5-dimethoxyphenyl)-2-(4-oxo-3,4-dihydroquinazolin-2-yl)prop-2-enenitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound 3643-1625
(2E)-3-(2,5-dimethoxyphenyl)-2-(4-oxo-3,4-dihydroquinazolin-2-yl)prop-2-enenitrile

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

3643-1625

Molecular Formula

C19H15N3O3 (C19 H15 N3 O3)

Compound Name

(2E)-3-(2,5-dimethoxyphenyl)-2-(4-oxo-3,4-dihydroquinazolin-2-yl)prop-2-enenitrile

IUPAC name

(2E)-3-(25-dimethoxyphenyl)-2-(4-oxo-34-dihydroquinazolin-2-yl)prop-2-enenitrile

SMILES

COc(cc1)cc(/C=C(/C(N2)=Nc(cccc3)c3C2=O)\C#N)c1OC

InChI

InChI=1S/C19H15N3O3/c1-24-14-7-8-17(25-2)12(10-14)9-13(11-20)18-21-16-6-4-3-5-15(16)19(23)22-18/h3-10H,1-2H3,(H,21,22,23)

InChI Key

NPJUDFYRNIOEHH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02350177

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

333.35

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.577

Distribution Coefficient, logD

1.516

Water Solubility, LogSw

-3.36

Polar Surface Area

67.121

Acid Dissociation Constant (pKa)

6.38

Base Dissociation Constant (pKb)

1.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.50

3643-1625 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin

References: we are preparing a list of scientific research reports with 3643-1625 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3643-1625?
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What is the minimum amount of 3643-1625 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3643-1625
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3643-1625
  • 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 3643-1625 available by request