C732-0224 Screening compound: N-cyclooctyl-1-[(2-oxo-1,2,3,4-tetrahydroquinolin-6-yl)sulfonyl]pyrrolidine-2-carboxamide

C732-0224 Screening compound: N-cyclooctyl-1-[(2-oxo-1,2,3,4-tetrahydroquinolin-6-yl)sulfonyl]pyrrolidine-2-carboxamide
C732-0224 Screening compound: N-cyclooctyl-1-[(2-oxo-1,2,3,4-tetrahydroquinolin-6-yl)sulfonyl]pyrrolidine-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C732-0224
N-cyclooctyl-1-[(2-oxo-1,2,3,4-tetrahydroquinolin-6-yl)sulfonyl]pyrrolidine-2-carboxamide

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

C732-0224

Molecular Formula

C22H31N3O4S (C22 H31 N3 O4 S)

Compound Name

N-cyclooctyl-1-[(2-oxo-1,2,3,4-tetrahydroquinolin-6-yl)sulfonyl]pyrrolidine-2-carboxamide

IUPAC name

N-cyclooctyl-1-[(2-oxo-1234-tetrahydroquinolin-6-yl)sulfonyl]pyrrolidine-2-carboxamide

SMILES

O=C(C(CCC1)N1S(c(cc1)cc(CC2)c1NC2=O)(=O)=O)NC1CCCCCCC1

InChI

InChI=1S/C22H31N3O4S/c26-21-13-10-16-15-18(11-12-19(16)24-21)30(28,29)25-14-6-9-20(25)22(27)23-17-7-4-2-1-3-5-8-17/h11-12,15,17,20H,1-10,13-14H2,(H,23,27)(H,24,26)/t20-/m0/s1

InChI Key

SOYMLSZZTPYZJB-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD15112723

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

433.57

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.985

Distribution Coefficient, logD

2.984

Water Solubility, LogSw

-3.48

Polar Surface Area

82.077

Acid Dissociation Constant (pKa)

9.90

Base Dissociation Constant (pKb)

-0.59

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

63.64

C732-0224 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 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 C732-0224 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C732-0224?
Check Price and Availability of C732-0224, 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 C732-0224 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C732-0224
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C732-0224
  • 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 C732-0224 available by request