S213-1248 Screening compound: 1-(3-chlorophenyl)-N-[(oxolan-3-yl)methyl]-N-propylmethanesulfonamide

S213-1248 Screening compound: 1-(3-chlorophenyl)-N-[(oxolan-3-yl)methyl]-N-propylmethanesulfonamide
S213-1248 Screening compound: 1-(3-chlorophenyl)-N-[(oxolan-3-yl)methyl]-N-propylmethanesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound S213-1248
1-(3-chlorophenyl)-N-[(oxolan-3-yl)methyl]-N-propylmethanesulfonamide

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

S213-1248

Molecular Formula

C15H22ClNO3S (C15 H22 ClNO3 S)

Compound Name

1-(3-chlorophenyl)-N-[(oxolan-3-yl)methyl]-N-propylmethanesulfonamide

IUPAC name

1-(3-chlorophenyl)-N-[(oxolan-3-yl)methyl]-N-propylmethanesulfonamide

SMILES

CCCN(CC1COCC1)S(Cc1cccc(Cl)c1)(=O)=O

InChI

InChI=1S/C15H22ClNO3S/c1-2-7-17(10-14-6-8-20-11-14)21(18,19)12-13-4-3-5-15(16)9-13/h3-5,9,14H,2,6-8,10-12H2,1H3/t14-/m1/s1

InChI Key

IWIVVKHVJWYQIE-CQSZACIVSA-N

MDL Number (MFCD)

MFCD29018330

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

331.86

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.314

Distribution Coefficient, logD

3.314

Water Solubility, LogSw

-3.58

Polar Surface Area

40.451

Acid Dissociation Constant (pKa)

20.21

Base Dissociation Constant (pKb)

-6.64

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

60.00

S213-1248 in Drug Discovery

Included in Screening Libraries

MDM2-p53 interaction inhibitors Library (21687 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with S213-1248 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S213-1248?
Check Price and Availability of S213-1248, 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 S213-1248 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S213-1248
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S213-1248
  • 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 S213-1248 available by request