SB75-1418 Screening compound: N~1~-[(3aR,5R,6aR)-2-benzyl-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]-2-ethoxyacetamide

SB75-1418 Screening compound: N~1~-[(3aR,5R,6aR)-2-benzyl-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]-2-ethoxyacetamide
SB75-1418 Screening compound: N~1~-[(3aR,5R,6aR)-2-benzyl-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]-2-ethoxyacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SB75-1418
N~1~-[(3aR,5R,6aR)-2-benzyl-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]-2-ethoxyacetamide

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

SB75-1418

Molecular Formula

C21H28N4O3 (C21 H28 N4 O3)

Compound Name

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

IUPAC name

N-[(3aR5R6aR)-2-benzyl-3a-(3-methyl-124-oxadiazol-5-yl)-octahydrocyclopenta[c]pyrrol-5-yl]-2-ethoxyacetamide

SMILES

CCOCC(N[C@H](C[C@H]1CN(Cc2ccccc2)C2)C[C@]12c1nc(C)no1)=O

InChI

InChI=1S/C21H28N4O3/c1-3-27-13-19(26)23-18-9-17-12-25(11-16-7-5-4-6-8-16)14-21(17,10-18)20-22-15(2)24-28-20/h4-8,17-18H,3,9-14H2,1-2H3,(H,23,26)/t17-,18-,21+/m1/s1

InChI Key

CNSZXYYLSGNBJQ-OPYAIIAOSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

384.48

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.856

Distribution Coefficient, logD

-1.290

Water Solubility, LogSw

-2.17

Polar Surface Area

67.844

Acid Dissociation Constant (pKa)

14.75

Base Dissociation Constant (pKb)

10.55

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

57.14

SB75-1418 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with SB75-1418 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SB75-1418?
Check Price and Availability of SB75-1418, 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 SB75-1418 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SB75-1418
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SB75-1418
  • 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 SB75-1418 available by request