T813-0200 Screening compound: 8-{[5-(3-METHOXYPHENYL)-1,2-OXAZOL-4-YL]METHYL}-1,4-DIOXA-8-AZASPIRO[4.5]DECANE

T813-0200 Screening compound: 8-{[5-(3-METHOXYPHENYL)-1,2-OXAZOL-4-YL]METHYL}-1,4-DIOXA-8-AZASPIRO[4.5]DECANE
T813-0200 Screening compound: 8-{[5-(3-METHOXYPHENYL)-1,2-OXAZOL-4-YL]METHYL}-1,4-DIOXA-8-AZASPIRO[4.5]DECANE alternative view

Chemical Structure Depiction of ChemDiv screening compound T813-0200
8-{[5-(3-METHOXYPHENYL)-1,2-OXAZOL-4-YL]METHYL}-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

T813-0200

Molecular Formula

C18H22N2O4 (C18 H22 N2 O4)

Compound Name

8-{[5-(3-METHOXYPHENYL)-1,2-OXAZOL-4-YL]METHYL}-1,4-DIOXA-8-AZASPIRO[4.5]DECANE

IUPAC name

n/a

SMILES

COc1cccc(-c2c(CN(CC3)CCC33OCCO3)cno2)c1

InChI

InChI=1S/C18H22N2O4/c1-21-16-4-2-3-14(11-16)17-15(12-19-24-17)13-20-7-5-18(6-8-20)22-9-10-23-18/h2-4,11-12H,5-10,13H2,1H3

InChI Key

QAJNCKOLSJFWQY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27623704

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

330.38

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.123

Distribution Coefficient, logD

0.621

Water Solubility, LogSw

-2.26

Polar Surface Area

48.143

Acid Dissociation Constant (pKa)

24.58

Base Dissociation Constant (pKb)

8.89

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

T813-0200 in Drug Discovery

Included in Screening Libraries

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with T813-0200 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T813-0200?
Check Price and Availability of T813-0200, 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 T813-0200 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T813-0200
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T813-0200
  • 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 T813-0200 available by request