C310-2395 Screening compound: (2Z)-2-[(3,4-dimethoxyphenyl)methylidene]-4-methyl-N-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide

C310-2395 Screening compound: (2Z)-2-[(3,4-dimethoxyphenyl)methylidene]-4-methyl-N-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
C310-2395 Screening compound: (2Z)-2-[(3,4-dimethoxyphenyl)methylidene]-4-methyl-N-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C310-2395
(2Z)-2-[(3,4-dimethoxyphenyl)methylidene]-4-methyl-N-[(4-methylphenyl)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

C310-2395

Molecular Formula

C27H26N2O4S (C27 H26 N2 O4 S)

Compound Name

(2Z)-2-[(3,4-dimethoxyphenyl)methylidene]-4-methyl-N-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide

IUPAC name

(2Z)-2-[(34-dimethoxyphenyl)methylidene]-4-methyl-N-[(4-methylphenyl)methyl]-3-oxo-34-dihydro-2H-14-benzothiazine-6-carboxamide

SMILES

Cc1ccc(CNC(c(cc2)cc(N(C)C3=O)c2S/C3=C\c(cc2)cc(OC)c2OC)=O)cc1

InChI

InChI=1S/C27H26N2O4S/c1-17-5-7-18(8-6-17)16-28-26(30)20-10-12-24-21(15-20)29(2)27(31)25(34-24)14-19-9-11-22(32-3)23(13-19)33-4/h5-15H,16H2,1-4H3,(H,28,30)

InChI Key

BNBQXYCGPUWQIY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14747446

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

474.58

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.382

Distribution Coefficient, logD

4.381

Water Solubility, LogSw

-4.33

Polar Surface Area

54.781

Acid Dissociation Constant (pKa)

12.49

Base Dissociation Constant (pKb)

-3.73

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.50

References: we are preparing a list of scientific research reports with C310-2395 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C310-2395?
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Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C310-2395
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C310-2395
  • 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 C310-2395 available by request