SB91-0192 Screening compound: N-[2-(morpholin-4-yl)ethyl]-3-(3-phenyl-1,2,4-oxadiazol-5-yl)-N-(pyrrolidin-3-yl)propanamide

SB91-0192 Screening compound: N-[2-(morpholin-4-yl)ethyl]-3-(3-phenyl-1,2,4-oxadiazol-5-yl)-N-(pyrrolidin-3-yl)propanamide
SB91-0192 Screening compound: N-[2-(morpholin-4-yl)ethyl]-3-(3-phenyl-1,2,4-oxadiazol-5-yl)-N-(pyrrolidin-3-yl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SB91-0192
N-[2-(morpholin-4-yl)ethyl]-3-(3-phenyl-1,2,4-oxadiazol-5-yl)-N-(pyrrolidin-3-yl)propanamide

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

SB91-0192

Molecular Formula

C21H29N5O3 (C21 H29 N5 O3)

Compound Name

N-[2-(morpholin-4-yl)ethyl]-3-(3-phenyl-1,2,4-oxadiazol-5-yl)-N-(pyrrolidin-3-yl)propanamide

IUPAC name

N-[2-(morpholin-4-yl)ethyl]-3-(3-phenyl-124-oxadiazol-5-yl)-N-(pyrrolidin-3-yl)propanamide

SMILES

O=C(CCc1nc(-c2ccccc2)no1)N(CCN1CCOCC1)C1CNCC1

InChI

InChI=1S/C21H29N5O3/c27-20(7-6-19-23-21(24-29-19)17-4-2-1-3-5-17)26(18-8-9-22-16-18)11-10-25-12-14-28-15-13-25/h1-5,18,22H,6-16H2/t18-/m0/s1

InChI Key

KSKNNGQTUAFYRL-SFHVURJKSA-N

MDL Number (MFCD)

MFCD32250297

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

399.49

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.321

Distribution Coefficient, logD

-1.433

Water Solubility, LogSw

-1.75

Polar Surface Area

70.365

Acid Dissociation Constant (pKa)

24.37

Base Dissociation Constant (pKb)

10.15

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

57.14

SB91-0192 in Drug Discovery

Included in Screening Libraries

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

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with SB91-0192 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SB91-0192?
Check Price and Availability of SB91-0192, 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 SB91-0192 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SB91-0192
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SB91-0192
  • 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 SB91-0192 available by request