4384-0083 Screening compound: (6Z)-6-[(3-ethoxy-4-hydroxyphenyl)methylidene]-5-imino-3-phenyl-5H,6H,7H-[1,3]thiazolo[3,2-a]pyrimidin-7-one

4384-0083 Screening compound: (6Z)-6-[(3-ethoxy-4-hydroxyphenyl)methylidene]-5-imino-3-phenyl-5H,6H,7H-[1,3]thiazolo[3,2-a]pyrimidin-7-one
4384-0083 Screening compound: (6Z)-6-[(3-ethoxy-4-hydroxyphenyl)methylidene]-5-imino-3-phenyl-5H,6H,7H-[1,3]thiazolo[3,2-a]pyrimidin-7-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 4384-0083
(6Z)-6-[(3-ethoxy-4-hydroxyphenyl)methylidene]-5-imino-3-phenyl-5H,6H,7H-[1,3]thiazolo[3,2-a]pyrimidin-7-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

4384-0083

Molecular Formula

C21H17N3O3S (C21 H17 N3 O3 S)

Compound Name

(6Z)-6-[(3-ethoxy-4-hydroxyphenyl)methylidene]-5-imino-3-phenyl-5H,6H,7H-[1,3]thiazolo[3,2-a]pyrimidin-7-one

IUPAC name

(6Z)-6-[(3-ethoxy-4-hydroxyphenyl)methylidene]-5-imino-3-phenyl-5H6H7H-[13]thiazolo[32-a]pyrimidin-7-one

SMILES

CCOc(cc(/C=C(/C(N(C(c1ccccc1)=CS1)C1=N1)=N)\C1=O)cc1)c1O

InChI

InChI=1S/C21H17N3O3S/c1-2-27-18-11-13(8-9-17(18)25)10-15-19(22)24-16(14-6-4-3-5-7-14)12-28-21(24)23-20(15)26/h3-12,22,25H,2H2,1H3

InChI Key

AJHZIFWQIDYHAK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02989692

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

391.45

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.916

Distribution Coefficient, logD

2.910

Water Solubility, LogSw

-3.28

Polar Surface Area

66.231

Acid Dissociation Constant (pKa)

9.63

Base Dissociation Constant (pKb)

5.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.50

References: we are preparing a list of scientific research reports with 4384-0083 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4384-0083?
Check Price and Availability of 4384-0083, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 4384-0083 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4384-0083
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4384-0083
  • 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 4384-0083 available by request