C732-0835 Screening compound: 2-{6-[(3,5-dimethylpiperidin-1-yl)sulfonyl]-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl}-N-[(pyridin-2-yl)methyl]acetamide

C732-0835 Screening compound: 2-{6-[(3,5-dimethylpiperidin-1-yl)sulfonyl]-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl}-N-[(pyridin-2-yl)methyl]acetamide
C732-0835 Screening compound: 2-{6-[(3,5-dimethylpiperidin-1-yl)sulfonyl]-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl}-N-[(pyridin-2-yl)methyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C732-0835
2-{6-[(3,5-dimethylpiperidin-1-yl)sulfonyl]-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl}-N-[(pyridin-2-yl)methyl]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

C732-0835

Molecular Formula

C22H26N4O5S (C22 H26 N4 O5 S)

Compound Name

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

IUPAC name

2-{6-[(35-dimethylpiperidin-1-yl)sulfonyl]-2-oxo-23-dihydro-13-benzoxazol-3-yl}-N-[(pyridin-2-yl)methyl]acetamide

SMILES

CC(CC(C)C1)CN1S(c(cc1)cc(O2)c1N(CC(NCc1ncccc1)=O)C2=O)(=O)=O

InChI

InChI=1S/C22H26N4O5S/c1-15-9-16(2)13-25(12-15)32(29,30)18-6-7-19-20(10-18)31-22(28)26(19)14-21(27)24-11-17-5-3-4-8-23-17/h3-8,10,15-16H,9,11-14H2,1-2H3,(H,24,27)

InChI Key

QYRYHEDWVBFQCN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14788982

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

458.54

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.457

Distribution Coefficient, logD

2.456

Water Solubility, LogSw

-2.88

Polar Surface Area

88.659

Acid Dissociation Constant (pKa)

13.07

Base Dissociation Constant (pKb)

4.74

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

40.90

References: we are preparing a list of scientific research reports with C732-0835 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C732-0835?
Check Price and Availability of C732-0835, 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 C732-0835 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C732-0835
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C732-0835
  • 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 C732-0835 available by request