4386-3909 Screening compound: 1-phenyl-3-[2-(4-sulfamoylphenyl)ethyl]thiourea

4386-3909 Screening compound: 1-phenyl-3-[2-(4-sulfamoylphenyl)ethyl]thiourea
4386-3909 Screening compound: 1-phenyl-3-[2-(4-sulfamoylphenyl)ethyl]thiourea alternative view

Chemical Structure Depiction of ChemDiv screening compound 4386-3909
1-phenyl-3-[2-(4-sulfamoylphenyl)ethyl]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

4386-3909

Molecular Formula

C15H17N3O2S2 (C15 H17 N3 O2 S2)

Compound Name

1-phenyl-3-[2-(4-sulfamoylphenyl)ethyl]thiourea

IUPAC name

1-phenyl-3-[2-(4-sulfamoylphenyl)ethyl]thiourea

SMILES

NS(c1ccc(CCNC(Nc2ccccc2)=S)cc1)(=O)=O

InChI

InChI=1S/C15H17N3O2S2/c16-22(19,20)14-8-6-12(7-9-14)10-11-17-15(21)18-13-4-2-1-3-5-13/h1-9H,10-11H2,(H2,16,19,20)(H2,17,18,21)

InChI Key

QOWRADOKRZQCAQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01975340

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

335.45

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.438

Distribution Coefficient, logD

1.437

Water Solubility, LogSw

-2.00

Polar Surface Area

70.828

Acid Dissociation Constant (pKa)

10.18

Base Dissociation Constant (pKb)

-0.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.30

4386-3909 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

Human Receptors Annotated Library (5376 compounds)

Therapeutical Diversity Annotated Library (7563 compounds)

Carbonic Anhydrase II Library (4939 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 4386-3909 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4386-3909?
Check Price and Availability of 4386-3909, 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 4386-3909 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4386-3909
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4386-3909
  • 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 4386-3909 available by request