2738-0478 Screening compound: N~6~-(3-chlorophenyl)-3-methyl-4-oxo-2-(phenylimino)-1,3-thiazinane-6-carboxamide

2738-0478 Screening compound: N~6~-(3-chlorophenyl)-3-methyl-4-oxo-2-(phenylimino)-1,3-thiazinane-6-carboxamide
2738-0478 Screening compound: N~6~-(3-chlorophenyl)-3-methyl-4-oxo-2-(phenylimino)-1,3-thiazinane-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2738-0478
N~6~-(3-chlorophenyl)-3-methyl-4-oxo-2-(phenylimino)-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

2738-0478

Molecular Formula

C18H16ClN3O2S (C18 H16 ClN3 O2 S)

Compound Name

N~6~-(3-chlorophenyl)-3-methyl-4-oxo-2-(phenylimino)-1,3-thiazinane-6-carboxamide

IUPAC name

(2E)-N-(3-chlorophenyl)-3-methyl-4-oxo-2-(phenylimino)-13-thiazinane-6-carboxamide

SMILES

CN(C(CC(C(Nc1cccc(Cl)c1)=O)S1)=O)/C1=N\c1ccccc1

InChI

InChI=1S/C18H16ClN3O2S/c1-22-16(23)11-15(17(24)20-14-9-5-6-12(19)10-14)25-18(22)21-13-7-3-2-4-8-13/h2-10,15H,11H2,1H3,(H,20,24)/t15-/m0/s1

InChI Key

GGSYHZSDFMRETD-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD14708374

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

373.86

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.510

Distribution Coefficient, logD

3.510

Water Solubility, LogSw

-3.86

Polar Surface Area

48.176

Acid Dissociation Constant (pKa)

10.62

Base Dissociation Constant (pKb)

4.46

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

16.67

References: we are preparing a list of scientific research reports with 2738-0478 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2738-0478?
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What is the minimum amount of 2738-0478 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2738-0478
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2738-0478
  • 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 2738-0478 available by request