G348-0441 Screening compound: 2-(6-benzyl-1,1-dioxo-1lambda~6~,2,6-thiadiazinan-2-yl)-N~1~-cyclohexylacetamide

G348-0441 Screening compound: 2-(6-benzyl-1,1-dioxo-1lambda~6~,2,6-thiadiazinan-2-yl)-N~1~-cyclohexylacetamide
G348-0441 Screening compound: 2-(6-benzyl-1,1-dioxo-1lambda~6~,2,6-thiadiazinan-2-yl)-N~1~-cyclohexylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G348-0441
2-(6-benzyl-1,1-dioxo-1lambda~6~,2,6-thiadiazinan-2-yl)-N~1~-cyclohexylacetamide

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

G348-0441

Molecular Formula

C18H27N3O3S (C18 H27 N3 O3 S)

Compound Name

2-(6-benzyl-1,1-dioxo-1lambda~6~,2,6-thiadiazinan-2-yl)-N~1~-cyclohexylacetamide

IUPAC name

2-(6-benzyl-11-dioxo-1lambda626-thiadiazinan-2-yl)-N-cyclohexylacetamide

SMILES

O=C(CN(CCCN1Cc2ccccc2)S1(=O)=O)NC1CCCCC1

InChI

InChI=1S/C18H27N3O3S/c22-18(19-17-10-5-2-6-11-17)15-21-13-7-12-20(25(21,23)24)14-16-8-3-1-4-9-16/h1,3-4,8-9,17H,2,5-7,10-15H2,(H,19,22)

InChI Key

QMPDCZYSVDTMFH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14999991

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

365.5

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.238

Distribution Coefficient, logD

2.238

Water Solubility, LogSw

-2.54

Polar Surface Area

60.576

Acid Dissociation Constant (pKa)

15.74

Base Dissociation Constant (pKb)

3.31

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

61.10

G348-0441 in Drug Discovery

Included in Screening Libraries

CNS MPO Library (28609 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with G348-0441 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G348-0441?
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What is the minimum amount of G348-0441 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G348-0441
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G348-0441
  • 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 G348-0441 available by request