5173-3215 Screening compound: butyl 3-(4-methylphenoxy)-4-oxo-4H-chromen-7-yl carbonate

5173-3215 Screening compound: butyl 3-(4-methylphenoxy)-4-oxo-4H-chromen-7-yl carbonate
5173-3215 Screening compound: butyl 3-(4-methylphenoxy)-4-oxo-4H-chromen-7-yl carbonate alternative view

Chemical Structure Depiction of ChemDiv screening compound 5173-3215
butyl 3-(4-methylphenoxy)-4-oxo-4H-chromen-7-yl carbonate

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

5173-3215

Molecular Formula

C21H20O6 (C21 H20 O6)

Compound Name

butyl 3-(4-methylphenoxy)-4-oxo-4H-chromen-7-yl carbonate

IUPAC name

butyl 3-(4-methylphenoxy)-4-oxo-4H-chromen-7-yl carbonate

SMILES

CCCCOC(Oc(cc1)cc(OC=C2Oc3ccc(C)cc3)c1C2=O)=O

InChI

InChI=1S/C21H20O6/c1-3-4-11-24-21(23)27-16-9-10-17-18(12-16)25-13-19(20(17)22)26-15-7-5-14(2)6-8-15/h5-10,12-13H,3-4,11H2,1-2H3

InChI Key

SJUTWAFCTPELDO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02960840

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

368.39

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.194

Distribution Coefficient, logD

4.194

Water Solubility, LogSw

-4.32

Polar Surface Area

56.629

Acid Dissociation Constant (pKa)

28.32

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

References: we are preparing a list of scientific research reports with 5173-3215 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5173-3215?
Check Price and Availability of 5173-3215, 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 5173-3215 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5173-3215
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5173-3215
  • 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 5173-3215 available by request