C732-0852 Screening compound: 2-{6-[(3,5-dimethylpiperidin-1-yl)sulfonyl]-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl}-N,N-dipropylacetamide

C732-0852 Screening compound: 2-{6-[(3,5-dimethylpiperidin-1-yl)sulfonyl]-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl}-N,N-dipropylacetamide
C732-0852 Screening compound: 2-{6-[(3,5-dimethylpiperidin-1-yl)sulfonyl]-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl}-N,N-dipropylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C732-0852
2-{6-[(3,5-dimethylpiperidin-1-yl)sulfonyl]-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl}-N,N-dipropylacetamide

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

C732-0852

Molecular Formula

C22H33N3O5S (C22 H33 N3 O5 S)

Compound Name

2-{6-[(3,5-dimethylpiperidin-1-yl)sulfonyl]-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl}-N,N-dipropylacetamide

IUPAC name

2-{6-[(35-dimethylpiperidin-1-yl)sulfonyl]-2-oxo-23-dihydro-13-benzoxazol-3-yl}-NN-dipropylacetamide

SMILES

CCCN(CCC)C(CN(c(ccc(S(N1CC(C)CC(C)C1)(=O)=O)c1)c1O1)C1=O)=O

InChI

InChI=1S/C22H33N3O5S/c1-5-9-23(10-6-2)21(26)15-25-19-8-7-18(12-20(19)30-22(25)27)31(28,29)24-13-16(3)11-17(4)14-24/h7-8,12,16-17H,5-6,9-11,13-15H2,1-4H3

InChI Key

BCQUUFRZDNRIJJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14788992

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

451.59

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.497

Distribution Coefficient, logD

3.497

Water Solubility, LogSw

-4.08

Polar Surface Area

70.828

Acid Dissociation Constant (pKa)

21.85

Base Dissociation Constant (pKb)

2.54

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

63.60

References: we are preparing a list of scientific research reports with C732-0852 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C732-0852?
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What is the minimum amount of C732-0852 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C732-0852
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C732-0852
  • 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 C732-0852 available by request