8018-7446 Screening compound: 3-nitro-2-(trichloromethyl)-2H-chromene

8018-7446 Screening compound: 3-nitro-2-(trichloromethyl)-2H-chromene
8018-7446 Screening compound: 3-nitro-2-(trichloromethyl)-2H-chromene alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-7446
3-nitro-2-(trichloromethyl)-2H-chromene

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

8018-7446

Molecular Formula

C10H6Cl3NO3 (C10 H6 Cl3 NO3)

Compound Name

3-nitro-2-(trichloromethyl)-2H-chromene

IUPAC name

3-nitro-2-(trichloromethyl)-2H-chromene

SMILES

[O-][N+](C1=Cc(cccc2)c2OC1C(Cl)(Cl)Cl)=O

InChI

InChI=1S/C10H6Cl3NO3/c11-10(12,13)9-7(14(15)16)5-6-3-1-2-4-8(6)17-9/h1-5,9H/t9-/m1/s1

InChI Key

YXYSGEIJKFSRPM-SECBINFHSA-N

MDL Number (MFCD)

MFCD08142886

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

294.52

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.984

Distribution Coefficient, logD

3.984

Water Solubility, LogSw

-4.37

Polar Surface Area

40.950

Acid Dissociation Constant (pKa)

22.06

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

20.00

8018-7446 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

New Agro Library (44492 compounds)

Opportunistic Pathogens of Immunocompromised Hosts Annotated Library (1773 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 8018-7446 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-7446?
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What is the minimum amount of 8018-7446 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-7446
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-7446
  • 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 8018-7446 available by request