K788-0178 Screening compound: 3-{3-[(4-chlorophenyl)sulfanyl]-2-methylpropyl}-1-phenylurea

K788-0178 Screening compound: 3-{3-[(4-chlorophenyl)sulfanyl]-2-methylpropyl}-1-phenylurea
K788-0178 Screening compound: 3-{3-[(4-chlorophenyl)sulfanyl]-2-methylpropyl}-1-phenylurea alternative view

Chemical Structure Depiction of ChemDiv screening compound K788-0178
3-{3-[(4-chlorophenyl)sulfanyl]-2-methylpropyl}-1-phenylurea

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

K788-0178

Molecular Formula

C17H19ClN2OS (C17 H19 ClN2 OS)

Compound Name

3-{3-[(4-chlorophenyl)sulfanyl]-2-methylpropyl}-1-phenylurea

IUPAC name

3-{3-[(4-chlorophenyl)sulfanyl]-2-methylpropyl}-1-phenylurea

SMILES

CC(CNC(Nc1ccccc1)=O)CSc(cc1)ccc1Cl

InChI

InChI=1S/C17H19ClN2OS/c1-13(12-22-16-9-7-14(18)8-10-16)11-19-17(21)20-15-5-3-2-4-6-15/h2-10,13H,11-12H2,1H3,(H2,19,20,21)/t13-/m0/s1

InChI Key

DQTHBWXHGPWASY-ZDUSSCGKSA-N

MDL Number (MFCD)

MFCD03834056

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

334.87

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.132

Distribution Coefficient, logD

5.132

Water Solubility, LogSw

-5.54

Polar Surface Area

33.864

Acid Dissociation Constant (pKa)

13.82

Base Dissociation Constant (pKb)

1.25

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

23.50

K788-0178 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 K788-0178 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K788-0178?
Check Price and Availability of K788-0178, 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 K788-0178 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K788-0178
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K788-0178
  • 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 K788-0178 available by request