L657-0394 Screening compound: 8-[2-(5-methylthiophen-2-yl)pyridine-4-carbonyl]-1,4-dioxa-8-azaspiro[4.5]decane

L657-0394 Screening compound: 8-[2-(5-methylthiophen-2-yl)pyridine-4-carbonyl]-1,4-dioxa-8-azaspiro[4.5]decane
L657-0394 Screening compound: 8-[2-(5-methylthiophen-2-yl)pyridine-4-carbonyl]-1,4-dioxa-8-azaspiro[4.5]decane alternative view

Chemical Structure Depiction of ChemDiv screening compound L657-0394
8-[2-(5-methylthiophen-2-yl)pyridine-4-carbonyl]-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

L657-0394

Molecular Formula

C18H20N2O3S (C18 H20 N2 O3 S)

Compound Name

8-[2-(5-methylthiophen-2-yl)pyridine-4-carbonyl]-1,4-dioxa-8-azaspiro[4.5]decane

IUPAC name

8-[2-(5-methylthiophen-2-yl)pyridine-4-carbonyl]-14-dioxa-8-azaspiro[4.5]decane

SMILES

Cc1ccc(-c2nccc(C(N(CC3)CCC33OCCO3)=O)c2)s1

InChI

InChI=1S/C18H20N2O3S/c1-13-2-3-16(24-13)15-12-14(4-7-19-15)17(21)20-8-5-18(6-9-20)22-10-11-23-18/h2-4,7,12H,5-6,8-11H2,1H3

InChI Key

AZFNUGDTVISJQW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27467618

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

344.43

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.456

Distribution Coefficient, logD

2.453

Water Solubility, LogSw

-2.60

Polar Surface Area

41.118

Acid Dissociation Constant (pKa)

27.30

Base Dissociation Constant (pKb)

5.20

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

44.40

References: we are preparing a list of scientific research reports with L657-0394 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L657-0394?
Check Price and Availability of L657-0394, 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 L657-0394 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L657-0394
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L657-0394
  • 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 L657-0394 available by request