8014-1206 Screening compound: N1-(5-nitroquinolin-8-yl)propane-1,3-diamine

8014-1206 Screening compound: N1-(5-nitroquinolin-8-yl)propane-1,3-diamine
8014-1206 Screening compound: N1-(5-nitroquinolin-8-yl)propane-1,3-diamine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8014-1206
N1-(5-nitroquinolin-8-yl)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

8014-1206

Molecular Formula

C12H14N4O2 (C12 H14 N4 O2)

Compound Name

N1-(5-nitroquinolin-8-yl)propane-1,3-diamine

IUPAC name

N1-(5-nitroquinolin-8-yl)propane-13-diamine

SMILES

NCCCNc(c1ncccc11)ccc1[N+]([O-])=O

InChI

InChI=1S/C12H14N4O2/c13-6-2-8-14-10-4-5-11(16(17)18)9-3-1-7-15-12(9)10/h1,3-5,7,14H,2,6,8,13H2

InChI Key

SFACCKTZHGCRMY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00440058

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

246.27

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.132

Distribution Coefficient, logD

-1.149

Water Solubility, LogSw

-2.08

Polar Surface Area

73.658

Acid Dissociation Constant (pKa)

18.68

Base Dissociation Constant (pKb)

9.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

8014-1206 in Drug Discovery

Included in Screening Libraries

Opportunistic Pathogens of Immunocompromised Hosts Annotated Library (1773 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 8014-1206 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8014-1206?
Check Price and Availability of 8014-1206, 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 8014-1206 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8014-1206
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8014-1206
  • 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 8014-1206 available by request