F052-1016 Screening compound: N1,N1,6-trimethyl-N3-[6-(pyrrolidine-1-sulfonyl)quinolin-2-yl]benzene-1,3-diamine

F052-1016 Screening compound: N1,N1,6-trimethyl-N3-[6-(pyrrolidine-1-sulfonyl)quinolin-2-yl]benzene-1,3-diamine
F052-1016 Screening compound: N1,N1,6-trimethyl-N3-[6-(pyrrolidine-1-sulfonyl)quinolin-2-yl]benzene-1,3-diamine alternative view

Chemical Structure Depiction of ChemDiv screening compound F052-1016
N1,N1,6-trimethyl-N3-[6-(pyrrolidine-1-sulfonyl)quinolin-2-yl]benzene-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

F052-1016

Molecular Formula

C22H26N4O2S (C22 H26 N4 O2 S)

Compound Name

N1,N1,6-trimethyl-N3-[6-(pyrrolidine-1-sulfonyl)quinolin-2-yl]benzene-1,3-diamine

IUPAC name

N1N16-trimethyl-N3-[6-(pyrrolidine-1-sulfonyl)quinolin-2-yl]benzene-13-diamine

SMILES

Cc(ccc(Nc1ccc(cc(cc2)S(N3CCCC3)(=O)=O)c2n1)c1)c1N(C)C

InChI

InChI=1S/C22H26N4O2S/c1-16-6-8-18(15-21(16)25(2)3)23-22-11-7-17-14-19(9-10-20(17)24-22)29(27,28)26-12-4-5-13-26/h6-11,14-15H,4-5,12-13H2,1-3H3,(H,23,24)

InChI Key

VIVXQWWWWVGJHQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27096689

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

410.54

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.025

Distribution Coefficient, logD

5.025

Water Solubility, LogSw

-4.84

Polar Surface Area

52.629

Acid Dissociation Constant (pKa)

19.45

Base Dissociation Constant (pKb)

4.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.80

F052-1016 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with F052-1016 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F052-1016?
Check Price and Availability of F052-1016, 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 F052-1016 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F052-1016
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F052-1016
  • 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 F052-1016 available by request