SB91-1098 Screening compound: N-[1-(2-cyclohexylacetyl)pyrrolidin-3-yl]-N-[2-(morpholin-4-yl)ethyl]acetamide

SB91-1098 Screening compound: N-[1-(2-cyclohexylacetyl)pyrrolidin-3-yl]-N-[2-(morpholin-4-yl)ethyl]acetamide
SB91-1098 Screening compound: N-[1-(2-cyclohexylacetyl)pyrrolidin-3-yl]-N-[2-(morpholin-4-yl)ethyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SB91-1098
N-[1-(2-cyclohexylacetyl)pyrrolidin-3-yl]-N-[2-(morpholin-4-yl)ethyl]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

SB91-1098

Molecular Formula

C20H35N3O3 (C20 H35 N3 O3)

Compound Name

N-[1-(2-cyclohexylacetyl)pyrrolidin-3-yl]-N-[2-(morpholin-4-yl)ethyl]acetamide

IUPAC name

N-[1-(2-cyclohexylacetyl)pyrrolidin-3-yl]-N-[2-(morpholin-4-yl)ethyl]acetamide

SMILES

CC(N(CCN1CCOCC1)C(CC1)CN1C(CC1CCCCC1)=O)=O

InChI

InChI=1S/C20H35N3O3/c1-17(24)23(10-9-21-11-13-26-14-12-21)19-7-8-22(16-19)20(25)15-18-5-3-2-4-6-18/h18-19H,2-16H2,1H3/t19-/m1/s1

InChI Key

JMIUIMKVMNITQW-LJQANCHMSA-N

MDL Number (MFCD)

MFCD32250241

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

365.52

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.480

Distribution Coefficient, logD

1.446

Water Solubility, LogSw

-1.43

Polar Surface Area

44.452

Acid Dissociation Constant (pKa)

24.54

Base Dissociation Constant (pKb)

6.31

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

90.00

SB91-1098 in Drug Discovery

Included in Screening Libraries

CNS MPO Library (28609 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with SB91-1098 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SB91-1098?
Check Price and Availability of SB91-1098, 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 SB91-1098 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SB91-1098
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SB91-1098
  • 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 SB91-1098 available by request