6359-0069 Screening compound: N-(4-methoxyphenyl)-N'-(6-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-4-oxo-1,4-dihydropyrimidin-2-yl)guanidine

6359-0069 Screening compound: N-(4-methoxyphenyl)-N'-(6-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-4-oxo-1,4-dihydropyrimidin-2-yl)guanidine
6359-0069 Screening compound: N-(4-methoxyphenyl)-N'-(6-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-4-oxo-1,4-dihydropyrimidin-2-yl)guanidine alternative view

Chemical Structure Depiction of ChemDiv screening compound 6359-0069
N-(4-methoxyphenyl)-N'-(6-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-4-oxo-1,4-dihydropyrimidin-2-yl)guanidine

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

6359-0069

Molecular Formula

C16H17N7O2S2 (C16 H17 N7 O2 S2)

Compound Name

N-(4-methoxyphenyl)-N'-(6-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-4-oxo-1,4-dihydropyrimidin-2-yl)guanidine

IUPAC name

N-(4-methoxyphenyl)-N'-(6-{[(5-methyl-134-thiadiazol-2-yl)sulfanyl]methyl}-4-oxo-14-dihydropyrimidin-2-yl)guanidine

SMILES

Cc1nnc(SCC(NC(NC(Nc(cc2)ccc2OC)=N)=N2)=CC2=O)s1

InChI

InChI=1S/C16H17N7O2S2/c1-9-22-23-16(27-9)26-8-11-7-13(24)20-15(19-11)21-14(17)18-10-3-5-12(25-2)6-4-10/h3-7H,8H2,1-2H3,(H4,17,18,19,20,21,24)

InChI Key

ZSPLVCOBGUAUGK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03871846

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

403.49

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.991

Distribution Coefficient, logD

0.623

Water Solubility, LogSw

-2.57

Polar Surface Area

102.601

Acid Dissociation Constant (pKa)

7.28

Base Dissociation Constant (pKb)

9.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.80

6359-0069 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with 6359-0069 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6359-0069?
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What is the minimum amount of 6359-0069 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6359-0069
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6359-0069
  • 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 6359-0069 available by request