8020-7298 Screening compound: methyl 3-(7-methoxy-1,3-benzodioxol-5-yl)-6-methyl-4-oxo-2,3-dihydro-4H-furo[3,2-c]pyran-2-carboxylate

8020-7298 Screening compound: methyl 3-(7-methoxy-1,3-benzodioxol-5-yl)-6-methyl-4-oxo-2,3-dihydro-4H-furo[3,2-c]pyran-2-carboxylate
8020-7298 Screening compound: methyl 3-(7-methoxy-1,3-benzodioxol-5-yl)-6-methyl-4-oxo-2,3-dihydro-4H-furo[3,2-c]pyran-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8020-7298
methyl 3-(7-methoxy-1,3-benzodioxol-5-yl)-6-methyl-4-oxo-2,3-dihydro-4H-furo[3,2-c]pyran-2-carboxylate

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

8020-7298

Molecular Formula

C18H16O8 (C18 H16 O8)

Compound Name

methyl 3-(7-methoxy-1,3-benzodioxol-5-yl)-6-methyl-4-oxo-2,3-dihydro-4H-furo[3,2-c]pyran-2-carboxylate

IUPAC name

methyl 3-(7-methoxy-2H-13-benzodioxol-5-yl)-6-methyl-4-oxo-2H3H4H-furo[32-c]pyran-2-carboxylate

SMILES

CC(O1)=CC(OC(C2c3cc(OC)c4OCOc4c3)C(OC)=O)=C2C1=O

InChI

InChI=1S/C18H16O8/c1-8-4-10-14(17(19)25-8)13(16(26-10)18(20)22-3)9-5-11(21-2)15-12(6-9)23-7-24-15/h4-6,13,16H,7H2,1-3H3

InChI Key

WHMFJUHUYOKBRU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD26098872

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

360.32

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.880

Distribution Coefficient, logD

1.880

Water Solubility, LogSw

-2.08

Polar Surface Area

76.135

Acid Dissociation Constant (pKa)

21.21

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

33.33

8020-7298 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with 8020-7298 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8020-7298?
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What is the minimum amount of 8020-7298 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8020-7298
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8020-7298
  • 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 8020-7298 available by request