V020-1847 Screening compound: 4-({[6,7,8-trimethoxy-3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}methyl)benzonitrile

V020-1847 Screening compound: 4-({[6,7,8-trimethoxy-3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}methyl)benzonitrile
V020-1847 Screening compound: 4-({[6,7,8-trimethoxy-3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}methyl)benzonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound V020-1847
4-({[6,7,8-trimethoxy-3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}methyl)benzonitrile

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

V020-1847

Molecular Formula

C26H23N3O5S (C26 H23 N3 O5 S)

Compound Name

4-({[6,7,8-trimethoxy-3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}methyl)benzonitrile

IUPAC name

4-({[678-trimethoxy-3-(4-methoxyphenyl)-4-oxo-34-dihydroquinazolin-2-yl]sulfanyl}methyl)benzonitrile

SMILES

COc(cc1)ccc1N(C(c1cc(OC)c2OC)=O)C(SCc(cc3)ccc3C#N)=Nc1c2OC

InChI

InChI=1S/C26H23N3O5S/c1-31-19-11-9-18(10-12-19)29-25(30)20-13-21(32-2)23(33-3)24(34-4)22(20)28-26(29)35-15-17-7-5-16(14-27)6-8-17/h5-13H,15H2,1-4H3

InChI Key

IXUYYJLSVYQONB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19858201

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

489.55

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.016

Distribution Coefficient, logD

4.016

Water Solubility, LogSw

-4.34

Polar Surface Area

70.572

Acid Dissociation Constant (pKa)

33.29

Base Dissociation Constant (pKb)

3.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.20

References: we are preparing a list of scientific research reports with V020-1847 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V020-1847?
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What is the minimum amount of V020-1847 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V020-1847
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V020-1847
  • 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 V020-1847 available by request