G769-0355 Screening compound: 2-{[(4-chlorobenzyl)(methyl)amino]methyl}-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one

G769-0355 Screening compound: 2-{[(4-chlorobenzyl)(methyl)amino]methyl}-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one
G769-0355 Screening compound: 2-{[(4-chlorobenzyl)(methyl)amino]methyl}-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound G769-0355
2-{[(4-chlorobenzyl)(methyl)amino]methyl}-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one

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

G769-0355

Molecular Formula

C19H20ClN3OS (C19 H20 ClN3 OS)

Compound Name

2-{[(4-chlorobenzyl)(methyl)amino]methyl}-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one

IUPAC name

11-({[(4-chlorophenyl)methyl](methyl)amino}methyl)-8-thia-110-diazatricyclo[7.4.0.0^{27}]trideca-2(7)911-trien-13-one

SMILES

CN(Cc(cc1)ccc1Cl)CC(N=C1SC(CCCC2)=C2N11)=CC1=O

InChI

InChI=1S/C19H20ClN3OS/c1-22(11-13-6-8-14(20)9-7-13)12-15-10-18(24)23-16-4-2-3-5-17(16)25-19(23)21-15/h6-10H,2-5,11-12H2,1H3

InChI Key

ZFULIAAYDRKXMX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08253209

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

373.91

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.232

Distribution Coefficient, logD

3.095

Water Solubility, LogSw

-3.68

Polar Surface Area

30.219

Acid Dissociation Constant (pKa)

26.83

Base Dissociation Constant (pKb)

6.97

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.80

G769-0355 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

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

CNS Targets (44014 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Nervous system
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with G769-0355 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G769-0355?
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What is the minimum amount of G769-0355 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G769-0355
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G769-0355
  • 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 G769-0355 available by request