F538-3763 Screening compound: N-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide

F538-3763 Screening compound: N-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide
F538-3763 Screening compound: N-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F538-3763
N-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide

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

F538-3763

Molecular Formula

C17H20N4O4 (C17 H20 N4 O4)

Compound Name

N-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide

IUPAC name

N-[3-(5-methyl-124-oxadiazol-3-yl)phenyl]-14-dioxa-8-azaspiro[4.5]decane-8-carboxamide

SMILES

Cc1nc(-c2cccc(NC(N(CC3)CCC33OCCO3)=O)c2)no1

InChI

InChI=1S/C17H20N4O4/c1-12-18-15(20-25-12)13-3-2-4-14(11-13)19-16(22)21-7-5-17(6-8-21)23-9-10-24-17/h2-4,11H,5-10H2,1H3,(H,19,22)

InChI Key

JNUKEDLBFHFSFK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14958513

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

344.37

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.155

Distribution Coefficient, logD

2.155

Water Solubility, LogSw

-2.91

Polar Surface Area

71.050

Acid Dissociation Constant (pKa)

14.27

Base Dissociation Constant (pKb)

3.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.10

F538-3763 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 F538-3763 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F538-3763?
Check Price and Availability of F538-3763, 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 F538-3763 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F538-3763
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F538-3763
  • 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 F538-3763 available by request