2738-0329 Screening compound: (2Z)-3-benzyl-2-[(4-chlorophenyl)imino]-N-(4-fluorophenyl)-4-oxo-1,3-thiazinane-6-carboxamide

2738-0329 Screening compound: (2Z)-3-benzyl-2-[(4-chlorophenyl)imino]-N-(4-fluorophenyl)-4-oxo-1,3-thiazinane-6-carboxamide
2738-0329 Screening compound: (2Z)-3-benzyl-2-[(4-chlorophenyl)imino]-N-(4-fluorophenyl)-4-oxo-1,3-thiazinane-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2738-0329
(2Z)-3-benzyl-2-[(4-chlorophenyl)imino]-N-(4-fluorophenyl)-4-oxo-1,3-thiazinane-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

2738-0329

Molecular Formula

C24H19ClFN3O2S (C24 H19 ClFN3 O2 S)

Compound Name

(2Z)-3-benzyl-2-[(4-chlorophenyl)imino]-N-(4-fluorophenyl)-4-oxo-1,3-thiazinane-6-carboxamide

IUPAC name

(2Z)-3-benzyl-2-[(4-chlorophenyl)imino]-N-(4-fluorophenyl)-4-oxo-13-thiazinane-6-carboxamide

SMILES

O=C(C(CC(N1Cc2ccccc2)=O)S/C1=N\c(cc1)ccc1Cl)Nc(cc1)ccc1F

InChI

InChI=1S/C24H19ClFN3O2S/c25-17-6-10-20(11-7-17)28-24-29(15-16-4-2-1-3-5-16)22(30)14-21(32-24)23(31)27-19-12-8-18(26)9-13-19/h1-13,21H,14-15H2,(H,27,31)/t21-/m0/s1

InChI Key

KBRHCWNGLJKESZ-NRFANRHFSA-N

MDL Number (MFCD)

MFCD02145746

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

467.95

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.342

Distribution Coefficient, logD

5.342

Water Solubility, LogSw

-5.89

Polar Surface Area

48.139

Acid Dissociation Constant (pKa)

10.70

Base Dissociation Constant (pKb)

4.09

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

12.50

References: we are preparing a list of scientific research reports with 2738-0329 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2738-0329?
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What is the minimum amount of 2738-0329 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2738-0329
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2738-0329
  • 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 2738-0329 available by request