4677-0048 Screening compound: N'-[(E)-(4-hydroxyphenyl)methylidene]-2-[(2-phenyl-5,6,7,8-tetrahydroquinazolin-4-yl)sulfanyl]acetohydrazide

4677-0048 Screening compound: N'-[(E)-(4-hydroxyphenyl)methylidene]-2-[(2-phenyl-5,6,7,8-tetrahydroquinazolin-4-yl)sulfanyl]acetohydrazide
4677-0048 Screening compound: N'-[(E)-(4-hydroxyphenyl)methylidene]-2-[(2-phenyl-5,6,7,8-tetrahydroquinazolin-4-yl)sulfanyl]acetohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4677-0048
N'-[(E)-(4-hydroxyphenyl)methylidene]-2-[(2-phenyl-5,6,7,8-tetrahydroquinazolin-4-yl)sulfanyl]acetohydrazide

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

4677-0048

Molecular Formula

C23H22N4O2S (C23 H22 N4 O2 S)

Compound Name

N'-[(E)-(4-hydroxyphenyl)methylidene]-2-[(2-phenyl-5,6,7,8-tetrahydroquinazolin-4-yl)sulfanyl]acetohydrazide

IUPAC name

N'-[(E)-(4-hydroxyphenyl)methylidene]-2-[(2-phenyl-5678-tetrahydroquinazolin-4-yl)sulfanyl]acetohydrazide

SMILES

Oc1ccc(/C=N/NC(CSc2nc(-c3ccccc3)nc3c2CCCC3)=O)cc1

InChI

InChI=1S/C23H22N4O2S/c28-18-12-10-16(11-13-18)14-24-27-21(29)15-30-23-19-8-4-5-9-20(19)25-22(26-23)17-6-2-1-3-7-17/h1-3,6-7,10-14,28H,4-5,8-9,15H2,(H,27,29)

InChI Key

CIDCYURCZOZVNA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03131253

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

418.52

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.003

Distribution Coefficient, logD

4.970

Water Solubility, LogSw

-4.63

Polar Surface Area

72.810

Acid Dissociation Constant (pKa)

9.88

Base Dissociation Constant (pKb)

6.29

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.70

References: we are preparing a list of scientific research reports with 4677-0048 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4677-0048?
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What is the minimum amount of 4677-0048 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4677-0048
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4677-0048
  • 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 4677-0048 available by request