5625-0033 Screening compound: 2-[(2E)-2-{[4-(benzyloxy)-3-methoxyphenyl]methylidene}hydrazin-1-yl]-4,5-dihydro-1,3-thiazol-4-one

5625-0033 Screening compound: 2-[(2E)-2-{[4-(benzyloxy)-3-methoxyphenyl]methylidene}hydrazin-1-yl]-4,5-dihydro-1,3-thiazol-4-one
5625-0033 Screening compound: 2-[(2E)-2-{[4-(benzyloxy)-3-methoxyphenyl]methylidene}hydrazin-1-yl]-4,5-dihydro-1,3-thiazol-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 5625-0033
2-[(2E)-2-{[4-(benzyloxy)-3-methoxyphenyl]methylidene}hydrazin-1-yl]-4,5-dihydro-1,3-thiazol-4-one

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

5625-0033

Molecular Formula

C18H17N3O3S (C18 H17 N3 O3 S)

Compound Name

2-[(2E)-2-{[4-(benzyloxy)-3-methoxyphenyl]methylidene}hydrazin-1-yl]-4,5-dihydro-1,3-thiazol-4-one

IUPAC name

2-[(2E)-2-{[4-(benzyloxy)-3-methoxyphenyl]methylidene}hydrazin-1-yl]-45-dihydro-13-thiazol-4-one

SMILES

COc(cc(/C=N/NC(SC1)=NC1=O)cc1)c1OCc1ccccc1

InChI

InChI=1S/C18H17N3O3S/c1-23-16-9-14(10-19-21-18-20-17(22)12-25-18)7-8-15(16)24-11-13-5-3-2-4-6-13/h2-10H,11-12H2,1H3,(H,20,21,22)

InChI Key

TVSWOCKDVQOPDU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03691033

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

355.42

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.834

Distribution Coefficient, logD

2.824

Water Solubility, LogSw

-3.34

Polar Surface Area

59.008

Acid Dissociation Constant (pKa)

9.03

Base Dissociation Constant (pKb)

3.36

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.67

References: we are preparing a list of scientific research reports with 5625-0033 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5625-0033?
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What is the minimum amount of 5625-0033 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5625-0033
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5625-0033
  • 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 5625-0033 available by request