5785-1640 Screening compound: 3-ethyl-1-[2-(4-sulfamoylphenyl)ethyl]thiourea

5785-1640 Screening compound: 3-ethyl-1-[2-(4-sulfamoylphenyl)ethyl]thiourea
5785-1640 Screening compound: 3-ethyl-1-[2-(4-sulfamoylphenyl)ethyl]thiourea alternative view

Chemical Structure Depiction of ChemDiv screening compound 5785-1640
3-ethyl-1-[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

5785-1640

Molecular Formula

C11H17N3O2S2 (C11 H17 N3 O2 S2)

Compound Name

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

IUPAC name

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

SMILES

CCNC(NCCc(cc1)ccc1S(N)(=O)=O)=S

InChI

InChI=1S/C11H17N3O2S2/c1-2-13-11(17)14-8-7-9-3-5-10(6-4-9)18(12,15)16/h3-6H,2,7-8H2,1H3,(H2,12,15,16)(H2,13,14,17)

InChI Key

UVPGBWVGVQACKF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02153169

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

287.41

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

0.018

Distribution Coefficient, logD

0.017

Water Solubility, LogSw

-1.86

Polar Surface Area

72.047

Acid Dissociation Constant (pKa)

10.18

Base Dissociation Constant (pKb)

-0.51

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.40

5785-1640 in Drug Discovery

Included in Screening Libraries

Carbonic Anhydrase II Library (4939 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 5785-1640 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5785-1640?
Check Price and Availability of 5785-1640, 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 5785-1640 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5785-1640
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5785-1640
  • 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 5785-1640 available by request