C885-4359 Screening compound: 2-[methyl({5-oxo-7-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-2-yl})amino]-N-propylacetamide

C885-4359 Screening compound: 2-[methyl({5-oxo-7-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-2-yl})amino]-N-propylacetamide
C885-4359 Screening compound: 2-[methyl({5-oxo-7-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-2-yl})amino]-N-propylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C885-4359
2-[methyl({5-oxo-7-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-2-yl})amino]-N-propylacetamide

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

C885-4359

Molecular Formula

C14H21N5O2S (C14 H21 N5 O2 S)

Compound Name

2-[methyl({5-oxo-7-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-2-yl})amino]-N-propylacetamide

IUPAC name

2-[methyl({5-oxo-7-propyl-5H-[134]thiadiazolo[32-a]pyrimidin-2-yl})amino]-N-propylacetamide

SMILES

CCCC(N=C1SC(N(C)CC(NCCC)=O)=NN11)=CC1=O

InChI

InChI=1S/C14H21N5O2S/c1-4-6-10-8-12(21)19-13(16-10)22-14(17-19)18(3)9-11(20)15-7-5-2/h8H,4-7,9H2,1-3H3,(H,15,20)

InChI Key

LOZKTTMSKLKJDT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14805406

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

323.42

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.455

Distribution Coefficient, logD

1.120

Water Solubility, LogSw

-1.88

Polar Surface Area

65.665

Acid Dissociation Constant (pKa)

15.66

Base Dissociation Constant (pKb)

7.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

57.10

C885-4359 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with C885-4359 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C885-4359?
Check Price and Availability of C885-4359, 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 C885-4359 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C885-4359
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C885-4359
  • 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 C885-4359 available by request