0365A-0006 Screening compound: 4-[4-(dimethylamino)-3-nitrobenzoyl]-N,N-dimethyl-2-nitroaniline

0365A-0006 Screening compound: 4-[4-(dimethylamino)-3-nitrobenzoyl]-N,N-dimethyl-2-nitroaniline
0365A-0006 Screening compound: 4-[4-(dimethylamino)-3-nitrobenzoyl]-N,N-dimethyl-2-nitroaniline alternative view

Chemical Structure Depiction of ChemDiv screening compound 0365A-0006
4-[4-(dimethylamino)-3-nitrobenzoyl]-N,N-dimethyl-2-nitroaniline

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

0365A-0006

Molecular Formula

C17H18N4O5 (C17 H18 N4 O5)

Compound Name

4-[4-(dimethylamino)-3-nitrobenzoyl]-N,N-dimethyl-2-nitroaniline

IUPAC name

4-[4-(dimethylamino)-3-nitrobenzoyl]-NN-dimethyl-2-nitroaniline

SMILES

CN(C)c(ccc(C(c(cc1)cc([N+]([O-])=O)c1N(C)C)=O)c1)c1[N+]([O-])=O

InChI

InChI=1S/C17H18N4O5/c1-18(2)13-7-5-11(9-15(13)20(23)24)17(22)12-6-8-14(19(3)4)16(10-12)21(25)26/h5-10H,1-4H3

InChI Key

ZVDVILJUONZMJX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00368723

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

358.35

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.488

Distribution Coefficient, logD

3.488

Water Solubility, LogSw

-4.02

Polar Surface Area

84.874

Acid Dissociation Constant (pKa)

30.86

Base Dissociation Constant (pKb)

-2.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.50

References: we are preparing a list of scientific research reports with 0365A-0006 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0365A-0006?
Check Price and Availability of 0365A-0006, 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 0365A-0006 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0365A-0006
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0365A-0006
  • 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 0365A-0006 available by request