C310-1883 Screening compound: (2Z)-2-[(2-fluorophenyl)methylidene]-4-methyl-3-oxo-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide

C310-1883 Screening compound: (2Z)-2-[(2-fluorophenyl)methylidene]-4-methyl-3-oxo-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
C310-1883 Screening compound: (2Z)-2-[(2-fluorophenyl)methylidene]-4-methyl-3-oxo-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C310-1883
(2Z)-2-[(2-fluorophenyl)methylidene]-4-methyl-3-oxo-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-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

C310-1883

Molecular Formula

C27H23FN2O2S (C27 H23 FN2 O2 S)

Compound Name

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

IUPAC name

(2Z)-2-[(2-fluorophenyl)methylidene]-4-methyl-3-oxo-N-(1234-tetrahydronaphthalen-1-yl)-34-dihydro-2H-14-benzothiazine-6-carboxamide

SMILES

CN(c(cc(cc1)C(NC(CCC2)c3c2cccc3)=O)c1S/C1=C\c(cccc2)c2F)C1=O

InChI

InChI=1S/C27H23FN2O2S/c1-30-23-15-19(26(31)29-22-12-6-9-17-7-2-4-10-20(17)22)13-14-24(23)33-25(27(30)32)16-18-8-3-5-11-21(18)28/h2-5,7-8,10-11,13-16,22H,6,9,12H2,1H3,(H,29,31)/t22-/m0/s1

InChI Key

QMTVBHRVKOJDJP-QFIPXVFZSA-N

MDL Number (MFCD)

MFCD14747295

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

458.56

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.549

Distribution Coefficient, logD

5.549

Water Solubility, LogSw

-5.39

Polar Surface Area

39.364

Acid Dissociation Constant (pKa)

11.50

Base Dissociation Constant (pKb)

-3.90

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

18.50

References: we are preparing a list of scientific research reports with C310-1883 chemical compound. It will be published here after verification.

Frequently Asked Questions

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Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C310-1883
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C310-1883
  • 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 C310-1883 available by request