0387-0176 Screening compound: 1-({10-[(piperidin-1-yl)methyl]anthracen-9-yl}methyl)piperidine

0387-0176 Screening compound: 1-({10-[(piperidin-1-yl)methyl]anthracen-9-yl}methyl)piperidine
0387-0176 Screening compound: 1-({10-[(piperidin-1-yl)methyl]anthracen-9-yl}methyl)piperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound 0387-0176
1-({10-[(piperidin-1-yl)methyl]anthracen-9-yl}methyl)piperidine

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

0387-0176

Molecular Formula

C26H32N2 (C26 H32 N2)

Compound Name

1-({10-[(piperidin-1-yl)methyl]anthracen-9-yl}methyl)piperidine

IUPAC name

1-({10-[(piperidin-1-yl)methyl]anthracen-9-yl}methyl)piperidine

SMILES

C(c1c(cccc2)c2c(CN2CCCCC2)c2ccccc12)N1CCCCC1

InChI

InChI=1S/C26H32N2/c1-7-15-27(16-8-1)19-25-21-11-3-5-13-23(21)26(20-28-17-9-2-10-18-28)24-14-6-4-12-22(24)25/h3-6,11-14H,1-2,7-10,15-20H2

InChI Key

PFDLZDOYLGOGKS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00356395

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

372.55

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

5.764

Distribution Coefficient, logD

3.770

Water Solubility, LogSw

-6.23

Polar Surface Area

7.160

Acid Dissociation Constant (pKa)

27.74

Base Dissociation Constant (pKb)

9.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

46.15

0387-0176 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 0387-0176 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0387-0176?
Check Price and Availability of 0387-0176, 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 0387-0176 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0387-0176
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0387-0176
  • 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 0387-0176 available by request