K786-7947 Screening compound: 1-(4-ethoxyphenyl)-3-[2-(4-methylpiperidin-1-yl)-5-[(4-methylpiperidin-1-yl)sulfonyl]phenyl]urea

K786-7947 Screening compound: 1-(4-ethoxyphenyl)-3-[2-(4-methylpiperidin-1-yl)-5-[(4-methylpiperidin-1-yl)sulfonyl]phenyl]urea
K786-7947 Screening compound: 1-(4-ethoxyphenyl)-3-[2-(4-methylpiperidin-1-yl)-5-[(4-methylpiperidin-1-yl)sulfonyl]phenyl]urea alternative view

Chemical Structure Depiction of ChemDiv screening compound K786-7947
1-(4-ethoxyphenyl)-3-[2-(4-methylpiperidin-1-yl)-5-[(4-methylpiperidin-1-yl)sulfonyl]phenyl]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

K786-7947

Molecular Formula

C27H38N4O4S (C27 H38 N4 O4 S)

Compound Name

1-(4-ethoxyphenyl)-3-[2-(4-methylpiperidin-1-yl)-5-[(4-methylpiperidin-1-yl)sulfonyl]phenyl]urea

IUPAC name

1-(4-ethoxyphenyl)-3-[2-(4-methylpiperidin-1-yl)-5-[(4-methylpiperidin-1-yl)sulfonyl]phenyl]urea

SMILES

CCOc(cc1)ccc1NC(Nc(cc(cc1)S(N2CCC(C)CC2)(=O)=O)c1N1CCC(C)CC1)=O

InChI

InChI=1S/C27H38N4O4S/c1-4-35-23-7-5-22(6-8-23)28-27(32)29-25-19-24(36(33,34)31-17-13-21(3)14-18-31)9-10-26(25)30-15-11-20(2)12-16-30/h5-10,19-21H,4,11-18H2,1-3H3,(H2,28,29,32)

InChI Key

LPEJETVTZTXAFH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03833514

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

514.69

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.971

Distribution Coefficient, logD

5.958

Water Solubility, LogSw

-5.50

Polar Surface Area

73.830

Acid Dissociation Constant (pKa)

8.92

Base Dissociation Constant (pKb)

7.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

51.90

K786-7947 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

CNS Targets (44014 compounds)

Immunological Library (6760 compounds)

Lipid Metabolism Library (9174 compounds)

Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Immune system
  • Cardiovascular
  • Metabolic
  • Cancer
  • Digestive system
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with K786-7947 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K786-7947?
Check Price and Availability of K786-7947, 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 K786-7947 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K786-7947
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K786-7947
  • 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 K786-7947 available by request