C732-0792 Screening compound: N-benzyl-2-oxo-3-[2-oxo-2-(4-propylpiperazin-1-yl)ethyl]-2,3-dihydro-1,3-benzoxazole-6-sulfonamide

C732-0792 Screening compound: N-benzyl-2-oxo-3-[2-oxo-2-(4-propylpiperazin-1-yl)ethyl]-2,3-dihydro-1,3-benzoxazole-6-sulfonamide
C732-0792 Screening compound: N-benzyl-2-oxo-3-[2-oxo-2-(4-propylpiperazin-1-yl)ethyl]-2,3-dihydro-1,3-benzoxazole-6-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C732-0792
N-benzyl-2-oxo-3-[2-oxo-2-(4-propylpiperazin-1-yl)ethyl]-2,3-dihydro-1,3-benzoxazole-6-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

C732-0792

Molecular Formula

C23H28N4O5S (C23 H28 N4 O5 S)

Compound Name

N-benzyl-2-oxo-3-[2-oxo-2-(4-propylpiperazin-1-yl)ethyl]-2,3-dihydro-1,3-benzoxazole-6-sulfonamide

IUPAC name

N-benzyl-2-oxo-3-[2-oxo-2-(4-propylpiperazin-1-yl)ethyl]-23-dihydro-13-benzoxazole-6-sulfonamide

SMILES

CCCN(CC1)CCN1C(CN(c(ccc(S(NCc1ccccc1)(=O)=O)c1)c1O1)C1=O)=O

InChI

InChI=1S/C23H28N4O5S/c1-2-10-25-11-13-26(14-12-25)22(28)17-27-20-9-8-19(15-21(20)32-23(27)29)33(30,31)24-16-18-6-4-3-5-7-18/h3-9,15,24H,2,10-14,16-17H2,1H3

InChI Key

OEXMJXQRAOUXCZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14788966

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

472.57

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.900

Distribution Coefficient, logD

1.717

Water Solubility, LogSw

-2.73

Polar Surface Area

85.008

Acid Dissociation Constant (pKa)

10.49

Base Dissociation Constant (pKb)

7.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

39.10

C732-0792 in Drug Discovery

Included in Screening Libraries

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

Dark Chemical Matter Library (18430 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with C732-0792 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C732-0792?
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What is the minimum amount of C732-0792 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C732-0792
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C732-0792
  • 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 C732-0792 available by request