SB95-0794 Screening compound: N'-benzyl-N-(2-morpholinoethyl)-N-(3-piperidyl)urea

SB95-0794 Screening compound: N'-benzyl-N-(2-morpholinoethyl)-N-(3-piperidyl)urea
SB95-0794 Screening compound: N'-benzyl-N-(2-morpholinoethyl)-N-(3-piperidyl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound SB95-0794
N'-benzyl-N-(2-morpholinoethyl)-N-(3-piperidyl)urea

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

SB95-0794

Molecular Formula

C19H30N4O2 (C19 H30 N4 O2)

Compound Name

N'-benzyl-N-(2-morpholinoethyl)-N-(3-piperidyl)urea

IUPAC name

1-benzyl-3-[2-(morpholin-4-yl)ethyl]-3-(piperidin-3-yl)urea

SMILES

O=C(NCc1ccccc1)N(CCN1CCOCC1)C1CNCCC1

InChI

InChI=1S/C19H30N4O2/c24-19(21-15-17-5-2-1-3-6-17)23(18-7-4-8-20-16-18)10-9-22-11-13-25-14-12-22/h1-3,5-6,18,20H,4,7-16H2,(H,21,24)/t18-/m0/s1

InChI Key

ZOJGMIANBMUGHA-SFHVURJKSA-N

MDL Number (MFCD)

MFCD32251395

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

346.47

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

0.433

Distribution Coefficient, logD

-3.181

Water Solubility, LogSw

-1.59

Polar Surface Area

49.327

Acid Dissociation Constant (pKa)

14.96

Base Dissociation Constant (pKb)

11.01

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

63.16

SB95-0794 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

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

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with SB95-0794 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SB95-0794?
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What is the minimum amount of SB95-0794 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SB95-0794
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SB95-0794
  • 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 SB95-0794 available by request