K788-9982 Screening compound: N-[3-(4-cyclohexylpiperazin-1-yl)propyl]-2-{[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]methanesulfinyl}acetamide

K788-9982 Screening compound: N-[3-(4-cyclohexylpiperazin-1-yl)propyl]-2-{[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]methanesulfinyl}acetamide
K788-9982 Screening compound: N-[3-(4-cyclohexylpiperazin-1-yl)propyl]-2-{[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]methanesulfinyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K788-9982
N-[3-(4-cyclohexylpiperazin-1-yl)propyl]-2-{[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]methanesulfinyl}acetamide

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

K788-9982

Molecular Formula

C27H40N4O3S (C27 H40 N4 O3 S)

Compound Name

N-[3-(4-cyclohexylpiperazin-1-yl)propyl]-2-{[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]methanesulfinyl}acetamide

IUPAC name

N-[3-(4-cyclohexylpiperazin-1-yl)propyl]-2-{[5-methyl-2-(4-methylphenyl)-13-oxazol-4-yl]methanesulfinyl}acetamide

SMILES

Cc1c(CS(CC(NCCCN(CC2)CCN2C2CCCCC2)=O)=O)nc(-c2ccc(C)cc2)o1

InChI

InChI=1S/C27H42N4O3S/c1-21-9-11-23(12-10-21)27-29-25(22(2)34-27)19-35(33)20-26(32)28-13-6-14-30-15-17-31(18-16-30)24-7-4-3-5-8-24/h9-12,24H,3-8,13-20,35H2,1-2H3,(H,28,32)

InChI Key

ARDXDAQMHOWPKT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15108932

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

500.71

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.939

Distribution Coefficient, logD

2.029

Water Solubility, LogSw

-3.27

Polar Surface Area

64.522

Acid Dissociation Constant (pKa)

15.30

Base Dissociation Constant (pKb)

8.25

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

63.00

K788-9982 in Drug Discovery

Included in Screening Libraries

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with K788-9982 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K788-9982?
Check Price and Availability of K788-9982, 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 K788-9982 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K788-9982
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K788-9982
  • 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 K788-9982 available by request