S959-0989 Screening compound: 3,5-dimethyl-N-{2-[3-(morpholin-4-yl)-2-oxopyrrolidin-1-yl]ethyl}benzamide

S959-0989 Screening compound: 3,5-dimethyl-N-{2-[3-(morpholin-4-yl)-2-oxopyrrolidin-1-yl]ethyl}benzamide
S959-0989 Screening compound: 3,5-dimethyl-N-{2-[3-(morpholin-4-yl)-2-oxopyrrolidin-1-yl]ethyl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound S959-0989
3,5-dimethyl-N-{2-[3-(morpholin-4-yl)-2-oxopyrrolidin-1-yl]ethyl}benzamide

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

S959-0989

Molecular Formula

C19H27N3O3 (C19 H27 N3 O3)

Compound Name

3,5-dimethyl-N-{2-[3-(morpholin-4-yl)-2-oxopyrrolidin-1-yl]ethyl}benzamide

IUPAC name

35-dimethyl-N-{2-[3-(morpholin-4-yl)-2-oxopyrrolidin-1-yl]ethyl}benzamide

SMILES

Cc1cc(C(NCCN(CCC2N3CCOCC3)C2=O)=O)cc(C)c1

InChI

InChI=1S/C19H27N3O3/c1-14-11-15(2)13-16(12-14)18(23)20-4-6-22-5-3-17(19(22)24)21-7-9-25-10-8-21/h11-13,17H,3-10H2,1-2H3,(H,20,23)/t17-/m0/s1

InChI Key

BRTBLERLEAMHCU-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD32231334

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

345.44

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.044

Distribution Coefficient, logD

1.042

Water Solubility, LogSw

-1.71

Polar Surface Area

52.195

Acid Dissociation Constant (pKa)

12.73

Base Dissociation Constant (pKb)

4.98

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

57.90

S959-0989 in Drug Discovery

Included in Screening Libraries

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with S959-0989 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S959-0989?
Check Price and Availability of S959-0989, 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 S959-0989 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S959-0989
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S959-0989
  • 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 S959-0989 available by request