3536-0066 Screening compound: 1-(4-chloro-2-methylphenyl)-3-(4-methylbenzenesulfonyl)urea

3536-0066 Screening compound: 1-(4-chloro-2-methylphenyl)-3-(4-methylbenzenesulfonyl)urea
3536-0066 Screening compound: 1-(4-chloro-2-methylphenyl)-3-(4-methylbenzenesulfonyl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound 3536-0066
1-(4-chloro-2-methylphenyl)-3-(4-methylbenzenesulfonyl)urea

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

3536-0066

Molecular Formula

C15H15ClN2O3S (C15 H15 ClN2 O3 S)

Compound Name

1-(4-chloro-2-methylphenyl)-3-(4-methylbenzenesulfonyl)urea

IUPAC name

1-(4-chloro-2-methylphenyl)-3-(4-methylbenzenesulfonyl)urea

SMILES

Cc(cc1)ccc1S(NC(Nc(cc1)c(C)cc1Cl)=O)(=O)=O

InChI

InChI=1S/C15H15ClN2O3S/c1-10-3-6-13(7-4-10)22(20,21)18-15(19)17-14-8-5-12(16)9-11(14)2/h3-9H,1-2H3,(H2,17,18,19)

InChI Key

WWNZCBCXXSYATB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02139779

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

338.81

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.020

Distribution Coefficient, logD

0.994

Water Solubility, LogSw

-4.29

Polar Surface Area

63.581

Acid Dissociation Constant (pKa)

4.37

Base Dissociation Constant (pKb)

-4.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.30

3536-0066 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 3536-0066 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3536-0066?
Check Price and Availability of 3536-0066, 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 3536-0066 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3536-0066
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3536-0066
  • 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 3536-0066 available by request