G373-2169 Screening compound: 4-(3,4-dihydro-2H-1,4-benzothiazin-4-yl)-N-[(3,4-dimethoxyphenyl)methyl]butanamide

G373-2169 Screening compound: 4-(3,4-dihydro-2H-1,4-benzothiazin-4-yl)-N-[(3,4-dimethoxyphenyl)methyl]butanamide
G373-2169 Screening compound: 4-(3,4-dihydro-2H-1,4-benzothiazin-4-yl)-N-[(3,4-dimethoxyphenyl)methyl]butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G373-2169
4-(3,4-dihydro-2H-1,4-benzothiazin-4-yl)-N-[(3,4-dimethoxyphenyl)methyl]butanamide

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

G373-2169

Molecular Formula

C21H26N2O3S (C21 H26 N2 O3 S)

Compound Name

4-(3,4-dihydro-2H-1,4-benzothiazin-4-yl)-N-[(3,4-dimethoxyphenyl)methyl]butanamide

IUPAC name

4-(34-dihydro-2H-14-benzothiazin-4-yl)-N-[(34-dimethoxyphenyl)methyl]butanamide

SMILES

COc(ccc(CNC(CCCN1c(cccc2)c2SCC1)=O)c1)c1OC

InChI

InChI=1S/C21H26N2O3S/c1-25-18-10-9-16(14-19(18)26-2)15-22-21(24)8-5-11-23-12-13-27-20-7-4-3-6-17(20)23/h3-4,6-7,9-10,14H,5,8,11-13,15H2,1-2H3,(H,22,24)

InChI Key

VNCOJBJUIQJJDJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27137621

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

386.52

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.462

Distribution Coefficient, logD

2.462

Water Solubility, LogSw

-2.83

Polar Surface Area

42.512

Acid Dissociation Constant (pKa)

14.52

Base Dissociation Constant (pKb)

9.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.10

G373-2169 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with G373-2169 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G373-2169?
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What is the minimum amount of G373-2169 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G373-2169
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G373-2169
  • 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 G373-2169 available by request