3583-1632 Screening compound: 6,7-dimethyl-2-{(Z)-1-[5-(1-oxo-1,3-dihydro-5-isobenzofuranyl)-2-furyl]methylidene}[1,3]thiazolo[3,2-a][1,3]benzimidazol-3-one

3583-1632 Screening compound: 6,7-dimethyl-2-{(Z)-1-[5-(1-oxo-1,3-dihydro-5-isobenzofuranyl)-2-furyl]methylidene}[1,3]thiazolo[3,2-a][1,3]benzimidazol-3-one
3583-1632 Screening compound: 6,7-dimethyl-2-{(Z)-1-[5-(1-oxo-1,3-dihydro-5-isobenzofuranyl)-2-furyl]methylidene}[1,3]thiazolo[3,2-a][1,3]benzimidazol-3-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 3583-1632
6,7-dimethyl-2-{(Z)-1-[5-(1-oxo-1,3-dihydro-5-isobenzofuranyl)-2-furyl]methylidene}[1,3]thiazolo[3,2-a][1,3]benzimidazol-3-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

3583-1632

Molecular Formula

C24H16N2O4S (C24 H16 N2 O4 S)

Compound Name

6,7-dimethyl-2-{(Z)-1-[5-(1-oxo-1,3-dihydro-5-isobenzofuranyl)-2-furyl]methylidene}[1,3]thiazolo[3,2-a][1,3]benzimidazol-3-one

IUPAC name

(4Z)-1011-dimethyl-4-{[5-(1-oxo-13-dihydro-2-benzofuran-5-yl)furan-2-yl]methylidene}-5-thia-27-diazatricyclo[6.4.0.0^{26}]dodeca-1(8)6911-tetraen-3-one

SMILES

Cc(c(C)c1)cc(n2C3=O)c1nc2S/C3=C\c1ccc(-c(cc2)cc(CO3)c2C3=O)o1

InChI

InChI=1S/C24H16N2O4S/c1-12-7-18-19(8-13(12)2)26-22(27)21(31-24(26)25-18)10-16-4-6-20(30-16)14-3-5-17-15(9-14)11-29-23(17)28/h3-10H,11H2,1-2H3

InChI Key

YPNZALKLLPWEFI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01824540

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

428.47

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.237

Distribution Coefficient, logD

5.237

Water Solubility, LogSw

-5.13

Polar Surface Area

54.595

Acid Dissociation Constant (pKa)

25.83

Base Dissociation Constant (pKb)

-1.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

3583-1632 in Drug Discovery

Included in Screening Libraries

DGK Inhibitors Library (10558 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Kinases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 3583-1632 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3583-1632?
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What is the minimum amount of 3583-1632 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3583-1632
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3583-1632
  • 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 3583-1632 available by request