3773-3764 Screening compound: (6Z)-6-{[4-(benzyloxy)-3-ethoxyphenyl]methylidene}-5-imino-2-(propan-2-yl)-5H,6H,7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one

3773-3764 Screening compound: (6Z)-6-{[4-(benzyloxy)-3-ethoxyphenyl]methylidene}-5-imino-2-(propan-2-yl)-5H,6H,7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
3773-3764 Screening compound: (6Z)-6-{[4-(benzyloxy)-3-ethoxyphenyl]methylidene}-5-imino-2-(propan-2-yl)-5H,6H,7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 3773-3764
(6Z)-6-{[4-(benzyloxy)-3-ethoxyphenyl]methylidene}-5-imino-2-(propan-2-yl)-5H,6H,7H-[1,3,4]thiadiazolo[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

3773-3764

Molecular Formula

C24H24N4O3S (C24 H24 N4 O3 S)

Compound Name

(6Z)-6-{[4-(benzyloxy)-3-ethoxyphenyl]methylidene}-5-imino-2-(propan-2-yl)-5H,6H,7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one

IUPAC name

(6Z)-6-{[4-(benzyloxy)-3-ethoxyphenyl]methylidene}-5-imino-2-(propan-2-yl)-5H6H7H-[134]thiadiazolo[32-a]pyrimidin-7-one

SMILES

CCOc(cc(/C=C(/C(N1N=C(C(C)C)SC1=N1)=N)\C1=O)cc1)c1OCc1ccccc1

InChI

InChI=1S/C24H24N4O3S/c1-4-30-20-13-17(10-11-19(20)31-14-16-8-6-5-7-9-16)12-18-21(25)28-24(26-22(18)29)32-23(27-28)15(2)3/h5-13,15,25H,4,14H2,1-3H3

InChI Key

OCDLKXXQHYEEJR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02118143

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

448.55

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.055

Distribution Coefficient, logD

2.287

Water Solubility, LogSw

-4.16

Polar Surface Area

69.543

Acid Dissociation Constant (pKa)

22.41

Base Dissociation Constant (pKb)

9.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with 3773-3764 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3773-3764?
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What is the minimum amount of 3773-3764 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3773-3764
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3773-3764
  • 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 3773-3764 available by request