8019-7129 Screening compound: N1-(2-nitrophenyl)propane-1,3-diamine

8019-7129 Screening compound: N1-(2-nitrophenyl)propane-1,3-diamine
8019-7129 Screening compound: N1-(2-nitrophenyl)propane-1,3-diamine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8019-7129
N1-(2-nitrophenyl)propane-1,3-diamine

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

8019-7129

Molecular Formula

C9H13N3O2 (C9 H13 N3 O2)

Compound Name

N1-(2-nitrophenyl)propane-1,3-diamine

IUPAC name

N1-(2-nitrophenyl)propane-13-diamine

SMILES

NCCCNc(cccc1)c1[N+]([O-])=O

InChI

InChI=1S/C9H13N3O2/c10-6-3-7-11-8-4-1-2-5-9(8)12(13)14/h1-2,4-5,11H,3,6-7,10H2

InChI Key

GVGDDEYVTBKACE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00622907

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

195.22

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.022

Distribution Coefficient, logD

-1.260

Water Solubility, LogSw

-1.98

Polar Surface Area

64.124

Acid Dissociation Constant (pKa)

18.62

Base Dissociation Constant (pKb)

9.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

8019-7129 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 8019-7129 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8019-7129?
Check Price and Availability of 8019-7129, 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 8019-7129 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8019-7129
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8019-7129
  • 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 8019-7129 available by request