G658-0237 Screening compound: 2-(3,4-dihydro-2H-1,4-benzothiazin-4-yl)-N-[3-(piperidin-1-yl)propyl]acetamide

G658-0237 Screening compound: 2-(3,4-dihydro-2H-1,4-benzothiazin-4-yl)-N-[3-(piperidin-1-yl)propyl]acetamide
G658-0237 Screening compound: 2-(3,4-dihydro-2H-1,4-benzothiazin-4-yl)-N-[3-(piperidin-1-yl)propyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G658-0237
2-(3,4-dihydro-2H-1,4-benzothiazin-4-yl)-N-[3-(piperidin-1-yl)propyl]acetamide

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

G658-0237

Molecular Formula

C18H27N3OS (C18 H27 N3 OS)

Compound Name

2-(3,4-dihydro-2H-1,4-benzothiazin-4-yl)-N-[3-(piperidin-1-yl)propyl]acetamide

IUPAC name

2-(34-dihydro-2H-14-benzothiazin-4-yl)-N-[3-(piperidin-1-yl)propyl]acetamide

SMILES

O=C(CN1c(cccc2)c2SCC1)NCCCN1CCCCC1

InChI

InChI=1S/C18H27N3OS/c22-18(19-9-6-12-20-10-4-1-5-11-20)15-21-13-14-23-17-8-3-2-7-16(17)21/h2-3,7-8H,1,4-6,9-15H2,(H,19,22)

InChI Key

BSUJQJWDNJSGHU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15026284

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

333.5

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.011

Distribution Coefficient, logD

-0.643

Water Solubility, LogSw

-2.48

Polar Surface Area

31.097

Acid Dissociation Constant (pKa)

15.46

Base Dissociation Constant (pKb)

10.05

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

61.10

G658-0237 in Drug Discovery

Included in Screening Libraries

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Targets:
  • GPCR
  • Ion Channels

References: we are preparing a list of scientific research reports with G658-0237 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G658-0237?
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What is the minimum amount of G658-0237 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G658-0237
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G658-0237
  • 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 G658-0237 available by request