SB95-1214 Screening compound: N-{1-[2-(3-methylphenoxy)acetyl]-3-piperidyl}-N-(2-morpholinoethyl)-1-cyclopropanecarboxamide

SB95-1214 Screening compound: N-{1-[2-(3-methylphenoxy)acetyl]-3-piperidyl}-N-(2-morpholinoethyl)-1-cyclopropanecarboxamide
SB95-1214 Screening compound: N-{1-[2-(3-methylphenoxy)acetyl]-3-piperidyl}-N-(2-morpholinoethyl)-1-cyclopropanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SB95-1214
N-{1-[2-(3-methylphenoxy)acetyl]-3-piperidyl}-N-(2-morpholinoethyl)-1-cyclopropanecarboxamide

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

SB95-1214

Molecular Formula

C24H35N3O4 (C24 H35 N3 O4)

Compound Name

N-{1-[2-(3-methylphenoxy)acetyl]-3-piperidyl}-N-(2-morpholinoethyl)-1-cyclopropanecarboxamide

IUPAC name

N-{1-[2-(3-methylphenoxy)acetyl]piperidin-3-yl}-N-[2-(morpholin-4-yl)ethyl]cyclopropanecarboxamide

SMILES

Cc1cccc(OCC(N(CCC2)CC2N(CCN2CCOCC2)C(C2CC2)=O)=O)c1

InChI

InChI=1S/C24H35N3O4/c1-19-4-2-6-22(16-19)31-18-23(28)26-9-3-5-21(17-26)27(24(29)20-7-8-20)11-10-25-12-14-30-15-13-25/h2,4,6,16,20-21H,3,5,7-15,17-18H2,1H3/t21-/m0/s1

InChI Key

ADNRHJRXGCZMSH-NRFANRHFSA-N

MDL Number (MFCD)

MFCD32251041

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

429.56

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.752

Distribution Coefficient, logD

1.702

Water Solubility, LogSw

-1.97

Polar Surface Area

51.177

Acid Dissociation Constant (pKa)

23.49

Base Dissociation Constant (pKb)

6.48

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

66.67

SB95-1214 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with SB95-1214 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SB95-1214?
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What is the minimum amount of SB95-1214 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SB95-1214
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SB95-1214
  • 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 SB95-1214 available by request