4964-3198 Screening compound: 1-[(2,3-DIMETHOXYPHENYL)METHYL]-4-(3-PHENYLPROPYL)PIPERAZINE

4964-3198 Screening compound: 1-[(2,3-DIMETHOXYPHENYL)METHYL]-4-(3-PHENYLPROPYL)PIPERAZINE
4964-3198 Screening compound: 1-[(2,3-DIMETHOXYPHENYL)METHYL]-4-(3-PHENYLPROPYL)PIPERAZINE alternative view

Chemical Structure Depiction of ChemDiv screening compound 4964-3198
1-[(2,3-DIMETHOXYPHENYL)METHYL]-4-(3-PHENYLPROPYL)PIPERAZINE

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

4964-3198

Molecular Formula

C22H30N2O2 (C22 H30 N2 O2)

Compound Name

1-[(2,3-DIMETHOXYPHENYL)METHYL]-4-(3-PHENYLPROPYL)PIPERAZINE

IUPAC name

n/a

SMILES

COc(cccc1CN2CCN(CCCc3ccccc3)CC2)c1OC

InChI

InChI=1S/C22H30N2O2/c1-25-21-12-6-11-20(22(21)26-2)18-24-16-14-23(15-17-24)13-7-10-19-8-4-3-5-9-19/h3-6,8-9,11-12H,7,10,13-18H2,1-2H3

InChI Key

LIBJAKMAMWESKG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03243038

Chemical and Physical Properties

Saltdata

HOOCCOOH

Molecular Weight

354.49

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.777

Distribution Coefficient, logD

2.526

Water Solubility, LogSw

-3.95

Polar Surface Area

22.837

Acid Dissociation Constant (pKa)

27.13

Base Dissociation Constant (pKb)

8.63

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.50

4964-3198 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 4964-3198 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4964-3198?
Check Price and Availability of 4964-3198, 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 4964-3198 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4964-3198
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4964-3198
  • 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 4964-3198 available by request