8019-6205 Screening compound: 5-(6-bromo-4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-4-methyl-4,5-dihydro-1,2-oxazole-3-carboxamide

8019-6205 Screening compound: 5-(6-bromo-4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-4-methyl-4,5-dihydro-1,2-oxazole-3-carboxamide
8019-6205 Screening compound: 5-(6-bromo-4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-4-methyl-4,5-dihydro-1,2-oxazole-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8019-6205
5-(6-bromo-4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-4-methyl-4,5-dihydro-1,2-oxazole-3-carboxamide

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

8019-6205

Molecular Formula

C14H15BrN2O6 (C14 H15 BrN2 O6)

Compound Name

5-(6-bromo-4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-4-methyl-4,5-dihydro-1,2-oxazole-3-carboxamide

IUPAC name

5-(6-bromo-47-dimethoxy-2H-13-benzodioxol-5-yl)-4-methyl-45-dihydro-12-oxazole-3-carboxamide

SMILES

CC1C(C(N)=O)=NOC1c(c(Br)c(c1c2OCO1)OC)c2OC

InChI

InChI=1S/C14H15BrN2O6/c1-5-8(14(16)18)17-23-9(5)6-7(15)11(20-3)13-12(10(6)19-2)21-4-22-13/h5,9H,4H2,1-3H3,(H2,16,18)

InChI Key

LOOHUGMBHWTYMJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD10038576

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

387.19

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.951

Distribution Coefficient, logD

1.951

Water Solubility, LogSw

-2.00

Polar Surface Area

88.622

Acid Dissociation Constant (pKa)

13.62

Base Dissociation Constant (pKb)

-0.29

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

42.90

8019-6205 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular

References: we are preparing a list of scientific research reports with 8019-6205 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8019-6205?
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What is the minimum amount of 8019-6205 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8019-6205
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8019-6205
  • 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 8019-6205 available by request