2421-0815 Screening compound: 5-[(2Z)-5-methoxy-3-methyl-2,3-dihydro-1,3-benzothiazol-2-ylidene]-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-4-one

2421-0815 Screening compound: 5-[(2Z)-5-methoxy-3-methyl-2,3-dihydro-1,3-benzothiazol-2-ylidene]-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-4-one
2421-0815 Screening compound: 5-[(2Z)-5-methoxy-3-methyl-2,3-dihydro-1,3-benzothiazol-2-ylidene]-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 2421-0815
5-[(2Z)-5-methoxy-3-methyl-2,3-dihydro-1,3-benzothiazol-2-ylidene]-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-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

2421-0815

Molecular Formula

C15H14N2O2S3 (C15 H14 N2 O2 S3)

Compound Name

5-[(2Z)-5-methoxy-3-methyl-2,3-dihydro-1,3-benzothiazol-2-ylidene]-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-4-one

IUPAC name

5-[(2Z)-5-methoxy-3-methyl-23-dihydro-13-benzothiazol-2-ylidene]-3-(prop-2-en-1-yl)-2-sulfanylidene-13-thiazolidin-4-one

SMILES

CN(c(cc(cc1)OC)c1S1)/C1=C(\C(N1CC=C)=O)/SC1=S

InChI

InChI=1S/C15H14N2O2S3/c1-4-7-17-13(18)12(22-15(17)20)14-16(2)10-8-9(19-3)5-6-11(10)21-14/h4-6,8H,1,7H2,2-3H3

InChI Key

QRVUAXXYZRVWER-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00570793

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

350.49

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.849

Distribution Coefficient, logD

3.849

Water Solubility, LogSw

-4.19

Polar Surface Area

28.410

Acid Dissociation Constant (pKa)

32.03

Base Dissociation Constant (pKb)

-1.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

References: we are preparing a list of scientific research reports with 2421-0815 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2421-0815?
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What is the minimum amount of 2421-0815 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2421-0815
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2421-0815
  • 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 2421-0815 available by request