1367-0062 Screening compound: 3-(carbamothioylsulfanyl)propanoic acid

1367-0062 Screening compound: 3-(carbamothioylsulfanyl)propanoic acid
1367-0062 Screening compound: 3-(carbamothioylsulfanyl)propanoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 1367-0062
3-(carbamothioylsulfanyl)propanoic acid

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

1367-0062

Molecular Formula

C4H7NO2S2 (C4 H7 NO2 S2)

Compound Name

3-(carbamothioylsulfanyl)propanoic acid

IUPAC name

3-(carbamothioylsulfanyl)propanoic acid

SMILES

NC(SCCC(O)=O)=S

InChI

InChI=1S/C4H7NO2S2/c5-4(8)9-2-1-3(6)7/h1-2H2,(H2,5,8)(H,6,7)

InChI Key

WIJJWWIBCIACQL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00022175

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

165.24

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

-0.043

Distribution Coefficient, logD

-2.739

Water Solubility, LogSw

-0.57

Polar Surface Area

48.039

Acid Dissociation Constant (pKa)

4.71

Base Dissociation Constant (pKb)

3.85

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

1367-0062 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 1367-0062 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1367-0062?
Check Price and Availability of 1367-0062, 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 1367-0062 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1367-0062
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1367-0062
  • 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 1367-0062 available by request