SB75-0031 Screening compound: N~1~-[(3aR,5R,6aR)-2-(2-methoxyacetyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]-2-(3-methyl-1H-pyrazol-1-yl)acetamide

SB75-0031 Screening compound: N~1~-[(3aR,5R,6aR)-2-(2-methoxyacetyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]-2-(3-methyl-1H-pyrazol-1-yl)acetamide
SB75-0031 Screening compound: N~1~-[(3aR,5R,6aR)-2-(2-methoxyacetyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]-2-(3-methyl-1H-pyrazol-1-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SB75-0031
N~1~-[(3aR,5R,6aR)-2-(2-methoxyacetyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]-2-(3-methyl-1H-pyrazol-1-yl)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

SB75-0031

Molecular Formula

C19H26N6O4 (C19 H26 N6 O4)

Compound Name

N~1~-[(3aR,5R,6aR)-2-(2-methoxyacetyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]-2-(3-methyl-1H-pyrazol-1-yl)acetamide

IUPAC name

N-[(3aR5R6aR)-2-(2-methoxyacetyl)-3a-(3-methyl-124-oxadiazol-5-yl)-octahydrocyclopenta[c]pyrrol-5-yl]-2-(3-methyl-1H-pyrazol-1-yl)acetamide

SMILES

Cc1nn(CC(N[C@H](C[C@H]2CN(C3)C(COC)=O)C[C@]23c2nc(C)no2)=O)cc1

InChI

InChI=1S/C19H26N6O4/c1-12-4-5-25(22-12)9-16(26)21-15-6-14-8-24(17(27)10-28-3)11-19(14,7-15)18-20-13(2)23-29-18/h4-5,14-15H,6-11H2,1-3H3,(H,21,26)/t14-,15+,19+/m1/s1

InChI Key

OAPRGBOSAXROIQ-VCBZYWHSSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

402.45

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

-0.575

Distribution Coefficient, logD

-0.575

Water Solubility, LogSw

-1.56

Polar Surface Area

95.064

Acid Dissociation Constant (pKa)

14.65

Base Dissociation Constant (pKb)

6.47

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

63.16

References: we are preparing a list of scientific research reports with SB75-0031 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SB75-0031?
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What is the minimum amount of SB75-0031 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SB75-0031
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SB75-0031
  • 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 SB75-0031 available by request