1823-0215 Screening compound: 4-methyl-2,6-dinitro-N-(2-phenylethyl)aniline

1823-0215 Screening compound: 4-methyl-2,6-dinitro-N-(2-phenylethyl)aniline
1823-0215 Screening compound: 4-methyl-2,6-dinitro-N-(2-phenylethyl)aniline alternative view

Chemical Structure Depiction of ChemDiv screening compound 1823-0215
4-methyl-2,6-dinitro-N-(2-phenylethyl)aniline

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

1823-0215

Molecular Formula

C15H15N3O4 (C15 H15 N3 O4)

Compound Name

4-methyl-2,6-dinitro-N-(2-phenylethyl)aniline

IUPAC name

4-methyl-26-dinitro-N-(2-phenylethyl)aniline

SMILES

Cc(cc1[N+]([O-])=O)cc([N+]([O-])=O)c1NCCc1ccccc1

InChI

InChI=1S/C15H15N3O4/c1-11-9-13(17(19)20)15(14(10-11)18(21)22)16-8-7-12-5-3-2-4-6-12/h2-6,9-10,16H,7-8H2,1H3

InChI Key

DTRJCTVAUMQBSH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00405932

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

301.3

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.395

Distribution Coefficient, logD

3.395

Water Solubility, LogSw

-3.78

Polar Surface Area

75.080

Acid Dissociation Constant (pKa)

13.51

Base Dissociation Constant (pKb)

-4.13

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

1823-0215 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 1823-0215 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1823-0215?
Check Price and Availability of 1823-0215, 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 1823-0215 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1823-0215
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1823-0215
  • 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 1823-0215 available by request