L716-0253 Screening compound: 8-[4-({3-[(4-chlorophenyl)sulfanyl]pyrazin-2-yl}oxy)benzoyl]-1,4-dioxa-8-azaspiro[4.5]decane

L716-0253 Screening compound: 8-[4-({3-[(4-chlorophenyl)sulfanyl]pyrazin-2-yl}oxy)benzoyl]-1,4-dioxa-8-azaspiro[4.5]decane
L716-0253 Screening compound: 8-[4-({3-[(4-chlorophenyl)sulfanyl]pyrazin-2-yl}oxy)benzoyl]-1,4-dioxa-8-azaspiro[4.5]decane alternative view

Chemical Structure Depiction of ChemDiv screening compound L716-0253
8-[4-({3-[(4-chlorophenyl)sulfanyl]pyrazin-2-yl}oxy)benzoyl]-1,4-dioxa-8-azaspiro[4.5]decane

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

L716-0253

Molecular Formula

C24H22ClN3O4S (C24 H22 ClN3 O4 S)

Compound Name

8-[4-({3-[(4-chlorophenyl)sulfanyl]pyrazin-2-yl}oxy)benzoyl]-1,4-dioxa-8-azaspiro[4.5]decane

IUPAC name

8-[4-({3-[(4-chlorophenyl)sulfanyl]pyrazin-2-yl}oxy)benzoyl]-14-dioxa-8-azaspiro[4.5]decane

SMILES

O=C(c(cc1)ccc1Oc1nccnc1Sc(cc1)ccc1Cl)N(CC1)CCC11OCCO1

InChI

InChI=1S/C24H22ClN3O4S/c25-18-3-7-20(8-4-18)33-22-21(26-11-12-27-22)32-19-5-1-17(2-6-19)23(29)28-13-9-24(10-14-28)30-15-16-31-24/h1-8,11-12H,9-10,13-16H2

InChI Key

QNILMEWQWJXDQK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15133780

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

483.98

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.200

Distribution Coefficient, logD

4.200

Water Solubility, LogSw

-4.68

Polar Surface Area

56.784

Acid Dissociation Constant (pKa)

27.30

Base Dissociation Constant (pKb)

-1.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.20

L716-0253 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with L716-0253 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L716-0253?
Check Price and Availability of L716-0253, 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 L716-0253 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L716-0253
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L716-0253
  • 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 L716-0253 available by request