K786-5199 Screening compound: ethyl 4-{[3-(cyclopentylcarbamoyl)piperidin-1-yl]sulfonyl}piperazine-1-carboxylate

K786-5199 Screening compound: ethyl 4-{[3-(cyclopentylcarbamoyl)piperidin-1-yl]sulfonyl}piperazine-1-carboxylate
K786-5199 Screening compound: ethyl 4-{[3-(cyclopentylcarbamoyl)piperidin-1-yl]sulfonyl}piperazine-1-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound K786-5199
ethyl 4-{[3-(cyclopentylcarbamoyl)piperidin-1-yl]sulfonyl}piperazine-1-carboxylate

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

K786-5199

Molecular Formula

C18H32N4O5S (C18 H32 N4 O5 S)

Compound Name

ethyl 4-{[3-(cyclopentylcarbamoyl)piperidin-1-yl]sulfonyl}piperazine-1-carboxylate

IUPAC name

ethyl 4-{[3-(cyclopentylcarbamoyl)piperidin-1-yl]sulfonyl}piperazine-1-carboxylate

SMILES

CCOC(N(CC1)CCN1S(N(CCC1)CC1C(NC1CCCC1)=O)(=O)=O)=O

InChI

InChI=1S/C18H32N4O5S/c1-2-27-18(24)20-10-12-21(13-11-20)28(25,26)22-9-5-6-15(14-22)17(23)19-16-7-3-4-8-16/h15-16H,2-14H2,1H3,(H,19,23)/t15-/m0/s1

InChI Key

XQWSKDDWFHNZGL-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD05028033

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

416.54

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

0.991

Distribution Coefficient, logD

0.991

Water Solubility, LogSw

-1.98

Polar Surface Area

81.573

Acid Dissociation Constant (pKa)

15.89

Base Dissociation Constant (pKb)

0.18

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

88.90

K786-5199 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with K786-5199 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K786-5199?
Check Price and Availability of K786-5199, 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 K786-5199 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K786-5199
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K786-5199
  • 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 K786-5199 available by request