8010-2387 Screening compound: 2-methyl-1-[(4-methylphenyl)methyl]-5-nitro-1H-imidazole

8010-2387 Screening compound: 2-methyl-1-[(4-methylphenyl)methyl]-5-nitro-1H-imidazole
8010-2387 Screening compound: 2-methyl-1-[(4-methylphenyl)methyl]-5-nitro-1H-imidazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 8010-2387
2-methyl-1-[(4-methylphenyl)methyl]-5-nitro-1H-imidazole

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

8010-2387

Molecular Formula

C12H13N3O2 (C12 H13 N3 O2)

Compound Name

2-methyl-1-[(4-methylphenyl)methyl]-5-nitro-1H-imidazole

IUPAC name

2-methyl-1-[(4-methylphenyl)methyl]-5-nitro-1H-imidazole

SMILES

Cc(n1Cc2ccc(C)cc2)ncc1[N+]([O-])=O

InChI

InChI=1S/C12H13N3O2/c1-9-3-5-11(6-4-9)8-14-10(2)13-7-12(14)15(16)17/h3-7H,8H2,1-2H3

InChI Key

UGCFQZBYJXGSJH-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

231.25

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.444

Distribution Coefficient, logD

2.444

Water Solubility, LogSw

-2.35

Polar Surface Area

44.688

Acid Dissociation Constant (pKa)

22.58

Base Dissociation Constant (pKb)

2.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with 8010-2387 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8010-2387?
Check Price and Availability of 8010-2387, 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 8010-2387 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8010-2387
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8010-2387
  • 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 8010-2387 available by request