SB95-0621 Screening compound: N-{1-[2-(4-methylphenyl)acetyl]-3-piperidyl}-N-[2-(1-pyrrolidinyl)ethyl]-1-cyclobutanecarboxamide

SB95-0621 Screening compound: N-{1-[2-(4-methylphenyl)acetyl]-3-piperidyl}-N-[2-(1-pyrrolidinyl)ethyl]-1-cyclobutanecarboxamide
SB95-0621 Screening compound: N-{1-[2-(4-methylphenyl)acetyl]-3-piperidyl}-N-[2-(1-pyrrolidinyl)ethyl]-1-cyclobutanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SB95-0621
N-{1-[2-(4-methylphenyl)acetyl]-3-piperidyl}-N-[2-(1-pyrrolidinyl)ethyl]-1-cyclobutanecarboxamide

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

SB95-0621

Molecular Formula

C25H37N3O2 (C25 H37 N3 O2)

Compound Name

N-{1-[2-(4-methylphenyl)acetyl]-3-piperidyl}-N-[2-(1-pyrrolidinyl)ethyl]-1-cyclobutanecarboxamide

IUPAC name

N-{1-[2-(4-methylphenyl)acetyl]piperidin-3-yl}-N-[2-(pyrrolidin-1-yl)ethyl]cyclobutanecarboxamide

SMILES

Cc1ccc(CC(N(CCC2)CC2N(CCN2CCCC2)C(C2CCC2)=O)=O)cc1

InChI

InChI=1S/C25H37N3O2/c1-20-9-11-21(12-10-20)18-24(29)27-15-5-8-23(19-27)28(25(30)22-6-4-7-22)17-16-26-13-2-3-14-26/h9-12,22-23H,2-8,13-19H2,1H3/t23-/m0/s1

InChI Key

HMXXJOSPMQORCR-QHCPKHFHSA-N

MDL Number (MFCD)

MFCD32251874

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

411.59

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.799

Distribution Coefficient, logD

0.844

Water Solubility, LogSw

-2.76

Polar Surface Area

36.135

Acid Dissociation Constant (pKa)

18.21

Base Dissociation Constant (pKb)

9.35

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

68.00

References: we are preparing a list of scientific research reports with SB95-0621 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SB95-0621?
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What is the minimum amount of SB95-0621 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SB95-0621
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SB95-0621
  • 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 SB95-0621 available by request