G595-0604 Screening compound: N~3~-[2-(4-methylpiperazino)ethyl]-4-oxo-7,8-dihydro-4H,6H-cyclopenta[4,5][1,3]thiazolo[3,2-a]pyrimidine-3-carboxamide

G595-0604 Screening compound: N~3~-[2-(4-methylpiperazino)ethyl]-4-oxo-7,8-dihydro-4H,6H-cyclopenta[4,5][1,3]thiazolo[3,2-a]pyrimidine-3-carboxamide
G595-0604 Screening compound: N~3~-[2-(4-methylpiperazino)ethyl]-4-oxo-7,8-dihydro-4H,6H-cyclopenta[4,5][1,3]thiazolo[3,2-a]pyrimidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G595-0604
N~3~-[2-(4-methylpiperazino)ethyl]-4-oxo-7,8-dihydro-4H,6H-cyclopenta[4,5][1,3]thiazolo[3,2-a]pyrimidine-3-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

G595-0604

Molecular Formula

C17H23N5O2S (C17 H23 N5 O2 S)

Compound Name

N~3~-[2-(4-methylpiperazino)ethyl]-4-oxo-7,8-dihydro-4H,6H-cyclopenta[4,5][1,3]thiazolo[3,2-a]pyrimidine-3-carboxamide

IUPAC name

N-[2-(4-methylpiperazin-1-yl)ethyl]-12-oxo-7-thia-19-diazatricyclo[6.4.0.0^{26}]dodeca-2(6)810-triene-11-carboxamide

SMILES

CN1CCN(CCNC(C2=CN=C3SC(CCC4)=C4N3C2=O)=O)CC1

InChI

InChI=1S/C17H23N5O2S/c1-20-7-9-21(10-8-20)6-5-18-15(23)12-11-19-17-22(16(12)24)13-3-2-4-14(13)25-17/h11H,2-10H2,1H3,(H,18,23)

InChI Key

RSXYVBGGAQXMKK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27145278

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

361.47

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

-0.463

Distribution Coefficient, logD

-1.131

Water Solubility, LogSw

-1.26

Polar Surface Area

57.703

Acid Dissociation Constant (pKa)

9.16

Base Dissociation Constant (pKb)

7.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

58.80

G595-0604 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with G595-0604 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G595-0604?
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What is the minimum amount of G595-0604 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G595-0604
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G595-0604
  • 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 G595-0604 available by request