G432-0181 Screening compound: N-(5-butyl-1,3,4-thiadiazol-2-yl)-2-[({5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl}methyl)sulfanyl]acetamide

G432-0181 Screening compound: N-(5-butyl-1,3,4-thiadiazol-2-yl)-2-[({5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl}methyl)sulfanyl]acetamide
G432-0181 Screening compound: N-(5-butyl-1,3,4-thiadiazol-2-yl)-2-[({5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl}methyl)sulfanyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G432-0181
N-(5-butyl-1,3,4-thiadiazol-2-yl)-2-[({5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl}methyl)sulfanyl]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

G432-0181

Molecular Formula

C15H17N5O2S3 (C15 H17 N5 O2 S3)

Compound Name

N-(5-butyl-1,3,4-thiadiazol-2-yl)-2-[({5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl}methyl)sulfanyl]acetamide

IUPAC name

N-(5-butyl-134-thiadiazol-2-yl)-2-[({5-oxo-5H-[13]thiazolo[32-a]pyrimidin-7-yl}methyl)sulfanyl]acetamide

SMILES

CCCCc1nnc(NC(CSCC(N=C2SC=CN22)=CC2=O)=O)s1

InChI

InChI=1S/C15H17N5O2S3/c1-2-3-4-12-18-19-14(25-12)17-11(21)9-23-8-10-7-13(22)20-5-6-24-15(20)16-10/h5-7H,2-4,8-9H2,1H3,(H,17,19,21)

InChI Key

SIAVHOMXNVICAC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15013847

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

395.53

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.446

Distribution Coefficient, logD

2.396

Water Solubility, LogSw

-2.66

Polar Surface Area

73.112

Acid Dissociation Constant (pKa)

8.31

Base Dissociation Constant (pKb)

-2.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

G432-0181 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Dark Chemical Matter Library (18430 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Pool

References: we are preparing a list of scientific research reports with G432-0181 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G432-0181?
Check Price and Availability of G432-0181, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of G432-0181 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G432-0181
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G432-0181
  • 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 G432-0181 available by request