3820-1788 Screening compound: 1-(4-nitrophenyl)-3-(thiophene-2-carbonyl)thiourea

3820-1788 Screening compound: 1-(4-nitrophenyl)-3-(thiophene-2-carbonyl)thiourea
3820-1788 Screening compound: 1-(4-nitrophenyl)-3-(thiophene-2-carbonyl)thiourea alternative view

Chemical Structure Depiction of ChemDiv screening compound 3820-1788
1-(4-nitrophenyl)-3-(thiophene-2-carbonyl)thiourea

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

3820-1788

Molecular Formula

C12H9N3O3S2 (C12 H9 N3 O3 S2)

Compound Name

1-(4-nitrophenyl)-3-(thiophene-2-carbonyl)thiourea

IUPAC name

1-(4-nitrophenyl)-3-(thiophene-2-carbonyl)thiourea

SMILES

[O-][N+](c(cc1)ccc1NC(NC(c1cccs1)=O)=S)=O

InChI

InChI=1S/C12H9N3O3S2/c16-11(10-2-1-7-20-10)14-12(19)13-8-3-5-9(6-4-8)15(17)18/h1-7H,(H2,13,14,16,19)

InChI Key

OVAXOKPOTLDQSA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02637818

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

307.35

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.241

Distribution Coefficient, logD

3.240

Water Solubility, LogSw

-3.69

Polar Surface Area

67.640

Acid Dissociation Constant (pKa)

9.93

Base Dissociation Constant (pKb)

-5.58

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

3820-1788 in Drug Discovery

Included in Screening Libraries

Human Proteases Annotated Library (2868 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 3820-1788 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3820-1788?
Check Price and Availability of 3820-1788, 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 3820-1788 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3820-1788
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3820-1788
  • 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 3820-1788 available by request