C310-2528 Screening compound: (2E)-N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[(2-chlorophenyl)methylidene]-4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide

C310-2528 Screening compound: (2E)-N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[(2-chlorophenyl)methylidene]-4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
C310-2528 Screening compound: (2E)-N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[(2-chlorophenyl)methylidene]-4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C310-2528
(2E)-N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[(2-chlorophenyl)methylidene]-4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide

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

C310-2528

Molecular Formula

C25H19ClN2O4S (C25 H19 ClN2 O4 S)

Compound Name

(2E)-N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[(2-chlorophenyl)methylidene]-4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide

IUPAC name

(2E)-N-[(2H-13-benzodioxol-5-yl)methyl]-2-[(2-chlorophenyl)methylidene]-4-methyl-3-oxo-34-dihydro-2H-14-benzothiazine-6-carboxamide

SMILES

CN(c(cc(cc1)C(NCc(cc2)cc3c2OCO3)=O)c1S/C1=C/c(cccc2)c2Cl)C1=O

InChI

InChI=1S/C25H19ClN2O4S/c1-28-19-11-17(24(29)27-13-15-6-8-20-21(10-15)32-14-31-20)7-9-22(19)33-23(25(28)30)12-16-4-2-3-5-18(16)26/h2-12H,13-14H2,1H3,(H,27,29)

InChI Key

GOFZUAVFBXUNSA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14747516

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

478.96

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.867

Distribution Coefficient, logD

4.867

Water Solubility, LogSw

-4.89

Polar Surface Area

56.636

Acid Dissociation Constant (pKa)

13.99

Base Dissociation Constant (pKb)

-3.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.00

References: we are preparing a list of scientific research reports with C310-2528 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C310-2528?
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What is the minimum amount of C310-2528 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C310-2528
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C310-2528
  • 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 C310-2528 available by request