SB91-0402 Screening compound: N-[2-(morpholin-4-yl)ethyl]-N-[1-(pyridine-3-sulfonyl)pyrrolidin-3-yl]methanesulfonamide

SB91-0402 Screening compound: N-[2-(morpholin-4-yl)ethyl]-N-[1-(pyridine-3-sulfonyl)pyrrolidin-3-yl]methanesulfonamide
SB91-0402 Screening compound: N-[2-(morpholin-4-yl)ethyl]-N-[1-(pyridine-3-sulfonyl)pyrrolidin-3-yl]methanesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SB91-0402
N-[2-(morpholin-4-yl)ethyl]-N-[1-(pyridine-3-sulfonyl)pyrrolidin-3-yl]methanesulfonamide

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

SB91-0402

Molecular Formula

C16H26N4O5S2 (C16 H26 N4 O5 S2)

Compound Name

N-[2-(morpholin-4-yl)ethyl]-N-[1-(pyridine-3-sulfonyl)pyrrolidin-3-yl]methanesulfonamide

IUPAC name

N-[2-(morpholin-4-yl)ethyl]-N-[1-(pyridine-3-sulfonyl)pyrrolidin-3-yl]methanesulfonamide

SMILES

CS(N(CCN1CCOCC1)C(CC1)CN1S(c1cnccc1)(=O)=O)(=O)=O

InChI

InChI=1S/C16H26N4O5S2/c1-26(21,22)20(8-7-18-9-11-25-12-10-18)15-4-6-19(14-15)27(23,24)16-3-2-5-17-13-16/h2-3,5,13,15H,4,6-12,14H2,1H3/t15-/m1/s1

InChI Key

KWYYJRZYLBPWMI-OAHLLOKOSA-N

MDL Number (MFCD)

MFCD32249994

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

418.54

Hydrogen Bond Acceptors Count

13.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

-0.552

Distribution Coefficient, logD

-0.552

Water Solubility, LogSw

-1.12

Polar Surface Area

84.595

Acid Dissociation Constant (pKa)

24.79

Base Dissociation Constant (pKb)

4.29

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

68.75

SB91-0402 in Drug Discovery

Included in Screening Libraries

CNS MPO Library (28609 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
Targets:
  • GPCR
  • Ion Channels

References: we are preparing a list of scientific research reports with SB91-0402 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SB91-0402?
Check Price and Availability of SB91-0402, 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 SB91-0402 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SB91-0402
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SB91-0402
  • 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 SB91-0402 available by request