3030-5366 Screening compound: 6-[(1Z)-2-(furan-2-yl)ethenyl]-5-nitro-1,2,3,4-tetrahydropyrimidine-2,4-dione

3030-5366 Screening compound: 6-[(1Z)-2-(furan-2-yl)ethenyl]-5-nitro-1,2,3,4-tetrahydropyrimidine-2,4-dione
3030-5366 Screening compound: 6-[(1Z)-2-(furan-2-yl)ethenyl]-5-nitro-1,2,3,4-tetrahydropyrimidine-2,4-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 3030-5366
6-[(1Z)-2-(furan-2-yl)ethenyl]-5-nitro-1,2,3,4-tetrahydropyrimidine-2,4-dione

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

3030-5366

Molecular Formula

C10H7N3O5 (C10 H7 N3 O5)

Compound Name

6-[(1Z)-2-(furan-2-yl)ethenyl]-5-nitro-1,2,3,4-tetrahydropyrimidine-2,4-dione

IUPAC name

6-[(1Z)-2-(furan-2-yl)ethenyl]-5-nitro-1234-tetrahydropyrimidine-24-dione

SMILES

[O-][N+](C(C(N1)=O)=C(/C=C\c2ccco2)NC1=O)=O

InChI

InChI=1S/C10H7N3O5/c14-9-8(13(16)17)7(11-10(15)12-9)4-3-6-2-1-5-18-6/h1-5H,(H2,11,12,14,15)

InChI Key

NRNPTNWIHBGAAS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01053911

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

249.18

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

0.918

Distribution Coefficient, logD

-2.197

Water Solubility, LogSw

-1.93

Polar Surface Area

90.157

Acid Dissociation Constant (pKa)

4.29

Base Dissociation Constant (pKb)

-6.94

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

References: we are preparing a list of scientific research reports with 3030-5366 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3030-5366?
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What is the minimum amount of 3030-5366 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3030-5366
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3030-5366
  • 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 3030-5366 available by request