8019-7154 Screening compound: methyl 5-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-4-methyl-4,5-dihydro-1,2-oxazole-3-carboxylate

8019-7154 Screening compound: methyl 5-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-4-methyl-4,5-dihydro-1,2-oxazole-3-carboxylate
8019-7154 Screening compound: methyl 5-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-4-methyl-4,5-dihydro-1,2-oxazole-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8019-7154
methyl 5-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-4-methyl-4,5-dihydro-1,2-oxazole-3-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

8019-7154

Molecular Formula

C15H17NO7 (C15 H17 NO7)

Compound Name

methyl 5-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-4-methyl-4,5-dihydro-1,2-oxazole-3-carboxylate

IUPAC name

methyl 5-(47-dimethoxy-2H-13-benzodioxol-5-yl)-4-methyl-45-dihydro-12-oxazole-3-carboxylate

SMILES

CC1C(C(OC)=O)=NOC1c(cc(c1c2OCO1)OC)c2OC

InChI

InChI=1S/C15H17NO7/c1-7-10(15(17)20-4)16-23-11(7)8-5-9(18-2)13-14(12(8)19-3)22-6-21-13/h5,7,11H,6H2,1-4H3

InChI Key

MWHNPDBQKKBMQH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD10039141

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

323.3

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.994

Distribution Coefficient, logD

1.994

Water Solubility, LogSw

-2.40

Polar Surface Area

75.650

Acid Dissociation Constant (pKa)

21.47

Base Dissociation Constant (pKb)

-2.02

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

46.70

8019-7154 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

CNS MPO Library (28609 compounds)

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Nervous system
  • Cardiovascular
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8019-7154 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8019-7154?
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What is the minimum amount of 8019-7154 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8019-7154
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8019-7154
  • 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 8019-7154 available by request