F141-0099 Screening compound: 6-methoxy-9-methyl-10-phenethyl-8-oxa-10,12-diazatricyclo[7.3.1.0~2,7~]trideca-2,4,6-triene-11-thione

F141-0099 Screening compound: 6-methoxy-9-methyl-10-phenethyl-8-oxa-10,12-diazatricyclo[7.3.1.0~2,7~]trideca-2,4,6-triene-11-thione
F141-0099 Screening compound: 6-methoxy-9-methyl-10-phenethyl-8-oxa-10,12-diazatricyclo[7.3.1.0~2,7~]trideca-2,4,6-triene-11-thione alternative view

Chemical Structure Depiction of ChemDiv screening compound F141-0099
6-methoxy-9-methyl-10-phenethyl-8-oxa-10,12-diazatricyclo[7.3.1.0~2,7~]trideca-2,4,6-triene-11-thione

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

F141-0099

Molecular Formula

C20H22N2O2S (C20 H22 N2 O2 S)

Compound Name

6-methoxy-9-methyl-10-phenethyl-8-oxa-10,12-diazatricyclo[7.3.1.0~2,7~]trideca-2,4,6-triene-11-thione

IUPAC name

6-methoxy-9-methyl-10-(2-phenylethyl)-8-oxa-1012-diazatricyclo[7.3.1.0^{27}]trideca-246-triene-11-thione

SMILES

CC(CC1N2)(N(CCc3ccccc3)C2=S)Oc2c1cccc2OC

InChI

InChI=1S/C20H22N2O2S/c1-20-13-16(15-9-6-10-17(23-2)18(15)24-20)21-19(25)22(20)12-11-14-7-4-3-5-8-14/h3-10,16H,11-13H2,1-2H3,(H,21,25)

InChI Key

ZAIAQKNMRAEKCW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09981252

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

354.47

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.093

Distribution Coefficient, logD

4.093

Water Solubility, LogSw

-4.33

Polar Surface Area

27.819

Acid Dissociation Constant (pKa)

15.07

Base Dissociation Constant (pKb)

-2.20

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

35.00

References: we are preparing a list of scientific research reports with F141-0099 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F141-0099?
Check Price and Availability of F141-0099, 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 F141-0099 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F141-0099
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F141-0099
  • 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 F141-0099 available by request