SB75-1034 Screening compound: N~4~-[(3aR,5R,6aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-2-(methylsulfonyl)octahydrocyclopenta[c]pyrrol-5-yl]-4-morpholinesulfonamide

SB75-1034 Screening compound: N~4~-[(3aR,5R,6aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-2-(methylsulfonyl)octahydrocyclopenta[c]pyrrol-5-yl]-4-morpholinesulfonamide
SB75-1034 Screening compound: N~4~-[(3aR,5R,6aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-2-(methylsulfonyl)octahydrocyclopenta[c]pyrrol-5-yl]-4-morpholinesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SB75-1034
N~4~-[(3aR,5R,6aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-2-(methylsulfonyl)octahydrocyclopenta[c]pyrrol-5-yl]-4-morpholinesulfonamide

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

SB75-1034

Molecular Formula

C15H25N5O6S2 (C15 H25 N5 O6 S2)

Compound Name

N~4~-[(3aR,5R,6aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-2-(methylsulfonyl)octahydrocyclopenta[c]pyrrol-5-yl]-4-morpholinesulfonamide

IUPAC name

N-[(3aR5R6aR)-2-methanesulfonyl-3a-(3-methyl-124-oxadiazol-5-yl)-octahydrocyclopenta[c]pyrrol-5-yl]morpholine-4-sulfonamide

SMILES

Cc1noc([C@@](C[C@@H](C2)NS(N3CCOCC3)(=O)=O)(C3)[C@@H]2CN3S(C)(=O)=O)n1

InChI

InChI=1S/C15H25N5O6S2/c1-11-16-14(26-17-11)15-8-13(7-12(15)9-20(10-15)27(2,21)22)18-28(23,24)19-3-5-25-6-4-19/h12-13,18H,3-10H2,1-2H3/t12-,13-,15+/m1/s1

InChI Key

SKORCAYAQBVXFI-NFAWXSAZSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

435.53

Hydrogen Bond Acceptors Count

15.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

-0.258

Distribution Coefficient, logD

-0.258

Water Solubility, LogSw

-1.63

Polar Surface Area

115.676

Acid Dissociation Constant (pKa)

12.30

Base Dissociation Constant (pKb)

-1.96

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

86.67

SB75-1034 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

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

PPI Helix Turn 3D-Mimetics Library (71298 compounds)

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with SB75-1034 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SB75-1034?
Check Price and Availability of SB75-1034, 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 SB75-1034 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SB75-1034
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SB75-1034
  • 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 SB75-1034 available by request