C308-0024 Screening compound: 4-{[(2Z)-4-[(2-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene]methyl}-N-[3-(morpholin-4-yl)propyl]benzamide

C308-0024 Screening compound: 4-{[(2Z)-4-[(2-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene]methyl}-N-[3-(morpholin-4-yl)propyl]benzamide
C308-0024 Screening compound: 4-{[(2Z)-4-[(2-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene]methyl}-N-[3-(morpholin-4-yl)propyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C308-0024
4-{[(2Z)-4-[(2-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene]methyl}-N-[3-(morpholin-4-yl)propyl]benzamide

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

C308-0024

Molecular Formula

C30H30FN3O3S (C30 H30 FN3 O3 S)

Compound Name

4-{[(2Z)-4-[(2-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene]methyl}-N-[3-(morpholin-4-yl)propyl]benzamide

IUPAC name

4-{[(2Z)-4-[(2-fluorophenyl)methyl]-3-oxo-34-dihydro-2H-14-benzothiazin-2-ylidene]methyl}-N-[3-(morpholin-4-yl)propyl]benzamide

SMILES

O=C(c1ccc(/C=C2\Sc(cccc3)c3N(Cc(cccc3)c3F)C2=O)cc1)NCCCN1CCOCC1

InChI

InChI=1S/C30H30FN3O3S/c31-25-7-2-1-6-24(25)21-34-26-8-3-4-9-27(26)38-28(30(34)36)20-22-10-12-23(13-11-22)29(35)32-14-5-15-33-16-18-37-19-17-33/h1-4,6-13,20H,5,14-19,21H2,(H,32,35)

InChI Key

GBLWOYKQXYSRTR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14746985

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

531.65

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.478

Distribution Coefficient, logD

4.089

Water Solubility, LogSw

-4.24

Polar Surface Area

51.215

Acid Dissociation Constant (pKa)

14.08

Base Dissociation Constant (pKb)

7.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.70

C308-0024 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C308-0024 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C308-0024?
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What is the minimum amount of C308-0024 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C308-0024
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C308-0024
  • 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 C308-0024 available by request