C482-0405 Screening compound: (6Z)-6-[(5-bromofuran-2-yl)methylidene]-7-imino-2-methyl-5H,6H,7H-[1,2]oxazolo[2,3-a]pyrimidin-5-one

C482-0405 Screening compound: (6Z)-6-[(5-bromofuran-2-yl)methylidene]-7-imino-2-methyl-5H,6H,7H-[1,2]oxazolo[2,3-a]pyrimidin-5-one
C482-0405 Screening compound: (6Z)-6-[(5-bromofuran-2-yl)methylidene]-7-imino-2-methyl-5H,6H,7H-[1,2]oxazolo[2,3-a]pyrimidin-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C482-0405
(6Z)-6-[(5-bromofuran-2-yl)methylidene]-7-imino-2-methyl-5H,6H,7H-[1,2]oxazolo[2,3-a]pyrimidin-5-one

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

C482-0405

Molecular Formula

C12H8BrN3O3 (C12 H8 BrN3 O3)

Compound Name

(6Z)-6-[(5-bromofuran-2-yl)methylidene]-7-imino-2-methyl-5H,6H,7H-[1,2]oxazolo[2,3-a]pyrimidin-5-one

IUPAC name

(6Z)-6-[(5-bromofuran-2-yl)methylidene]-7-imino-2-methyl-5H6H7H-[12]oxazolo[23-a]pyrimidin-5-one

SMILES

CC(ON1C(/C2=C/c(o3)ccc3Br)=N)=CC1=NC2=O

InChI

InChI=1S/C12H8BrN3O3/c1-6-4-10-15-12(17)8(11(14)16(10)19-6)5-7-2-3-9(13)18-7/h2-5,14H,1H3

InChI Key

AXBARBTZUKCRHB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14761009

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

322.12

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.259

Distribution Coefficient, logD

-0.377

Water Solubility, LogSw

-1.91

Polar Surface Area

63.275

Acid Dissociation Constant (pKa)

32.91

Base Dissociation Constant (pKb)

9.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.30

C482-0405 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with C482-0405 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C482-0405?
Check Price and Availability of C482-0405, 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 C482-0405 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C482-0405
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C482-0405
  • 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 C482-0405 available by request