5610-0426 Screening compound: N-[2-hydroxy-3-(4-nitrophenoxy)propyl]-2-(piperidine-1-carbonyl)benzene-1-sulfonamide

5610-0426 Screening compound: N-[2-hydroxy-3-(4-nitrophenoxy)propyl]-2-(piperidine-1-carbonyl)benzene-1-sulfonamide
5610-0426 Screening compound: N-[2-hydroxy-3-(4-nitrophenoxy)propyl]-2-(piperidine-1-carbonyl)benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 5610-0426
N-[2-hydroxy-3-(4-nitrophenoxy)propyl]-2-(piperidine-1-carbonyl)benzene-1-sulfonamide

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

5610-0426

Molecular Formula

C21H25N3O7S (C21 H25 N3 O7 S)

Compound Name

N-[2-hydroxy-3-(4-nitrophenoxy)propyl]-2-(piperidine-1-carbonyl)benzene-1-sulfonamide

IUPAC name

N-[2-hydroxy-3-(4-nitrophenoxy)propyl]-2-(piperidine-1-carbonyl)benzene-1-sulfonamide

SMILES

[O-][N+](c(cc1)ccc1OCC(CNS(c(cccc1)c1C(N1CCCCC1)=O)(=O)=O)O)=O

InChI

InChI=1S/C21H25N3O7S/c25-17(15-31-18-10-8-16(9-11-18)24(27)28)14-22-32(29,30)20-7-3-2-6-19(20)21(26)23-12-4-1-5-13-23/h2-3,6-11,17,22,25H,1,4-5,12-15H2/t17-/m0/s1

InChI Key

RROWPVIANBFZLM-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD02171782

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

463.51

Hydrogen Bond Acceptors Count

13.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.325

Distribution Coefficient, logD

2.325

Water Solubility, LogSw

-2.97

Polar Surface Area

116.145

Acid Dissociation Constant (pKa)

10.16

Base Dissociation Constant (pKb)

-2.83

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

38.10

5610-0426 in Drug Discovery

Included in Screening Libraries

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with 5610-0426 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5610-0426?
Check Price and Availability of 5610-0426, 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 5610-0426 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5610-0426
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5610-0426
  • 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 5610-0426 available by request