1986-3921 Screening compound: ethyl 2-[(4,8-dimethyl-2-oxo-2H-chromen-7-yl)oxy]butanoate

1986-3921 Screening compound: ethyl 2-[(4,8-dimethyl-2-oxo-2H-chromen-7-yl)oxy]butanoate
1986-3921 Screening compound: ethyl 2-[(4,8-dimethyl-2-oxo-2H-chromen-7-yl)oxy]butanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 1986-3921
ethyl 2-[(4,8-dimethyl-2-oxo-2H-chromen-7-yl)oxy]butanoate

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

1986-3921

Molecular Formula

C17H20O5 (C17 H20 O5)

Compound Name

ethyl 2-[(4,8-dimethyl-2-oxo-2H-chromen-7-yl)oxy]butanoate

IUPAC name

ethyl 2-[(48-dimethyl-2-oxo-2H-chromen-7-yl)oxy]butanoate

SMILES

CCC(C(OCC)=O)Oc(cc1)c(C)c(O2)c1C(C)=CC2=O

InChI

InChI=1S/C17H20O5/c1-5-13(17(19)20-6-2)21-14-8-7-12-10(3)9-15(18)22-16(12)11(14)4/h7-9,13H,5-6H2,1-4H3

InChI Key

DUNLJVANTFTYRI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01106629

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

304.34

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.722

Distribution Coefficient, logD

3.722

Water Solubility, LogSw

-4.01

Polar Surface Area

47.842

Acid Dissociation Constant (pKa)

22.84

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

41.20

References: we are preparing a list of scientific research reports with 1986-3921 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1986-3921?
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What is the minimum amount of 1986-3921 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1986-3921
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1986-3921
  • 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 1986-3921 available by request