C201-0807 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[2-oxo-6-(piperidine-1-sulfonyl)-1,2-dihydroquinoxalin-1-yl]acetamide

C201-0807 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[2-oxo-6-(piperidine-1-sulfonyl)-1,2-dihydroquinoxalin-1-yl]acetamide
C201-0807 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[2-oxo-6-(piperidine-1-sulfonyl)-1,2-dihydroquinoxalin-1-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C201-0807
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[2-oxo-6-(piperidine-1-sulfonyl)-1,2-dihydroquinoxalin-1-yl]acetamide

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

C201-0807

Molecular Formula

C23H24N4O6S (C23 H24 N4 O6 S)

Compound Name

N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[2-oxo-6-(piperidine-1-sulfonyl)-1,2-dihydroquinoxalin-1-yl]acetamide

IUPAC name

N-[(2H-13-benzodioxol-5-yl)methyl]-2-[2-oxo-6-(piperidine-1-sulfonyl)-12-dihydroquinoxalin-1-yl]acetamide

SMILES

O=C(CN(c(ccc(S(N1CCCCC1)(=O)=O)c1)c1N=C1)C1=O)NCc(cc1)cc2c1OCO2

InChI

InChI=1S/C23H24N4O6S/c28-22(25-12-16-4-7-20-21(10-16)33-15-32-20)14-27-19-6-5-17(11-18(19)24-13-23(27)29)34(30,31)26-8-2-1-3-9-26/h4-7,10-11,13H,1-3,8-9,12,14-15H2,(H,25,28)

InChI Key

BNLYPUWXQGQXNY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD11993951

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

484.53

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

1.949

Distribution Coefficient, logD

1.949

Water Solubility, LogSw

-2.84

Polar Surface Area

97.949

Acid Dissociation Constant (pKa)

14.68

Base Dissociation Constant (pKb)

-0.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.80

C201-0807 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C201-0807 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C201-0807?
Check Price and Availability of C201-0807, 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 C201-0807 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C201-0807
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C201-0807
  • 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 C201-0807 available by request