C201-1278 Screening compound: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-[4-(piperidin-1-yl)phthalazin-1-yl]piperidine-4-carboxamide

C201-1278 Screening compound: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-[4-(piperidin-1-yl)phthalazin-1-yl]piperidine-4-carboxamide
C201-1278 Screening compound: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-[4-(piperidin-1-yl)phthalazin-1-yl]piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C201-1278
N-[2-(3,4-dimethoxyphenyl)ethyl]-1-[4-(piperidin-1-yl)phthalazin-1-yl]piperidine-4-carboxamide

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

C201-1278

Molecular Formula

C29H37N5O3 (C29 H37 N5 O3)

Compound Name

N-[2-(3,4-dimethoxyphenyl)ethyl]-1-[4-(piperidin-1-yl)phthalazin-1-yl]piperidine-4-carboxamide

IUPAC name

N-[2-(34-dimethoxyphenyl)ethyl]-1-[4-(piperidin-1-yl)phthalazin-1-yl]piperidine-4-carboxamide

SMILES

COc(ccc(CCNC(C(CC1)CCN1c(c1ccccc11)nnc1N1CCCCC1)=O)c1)c1OC

InChI

InChI=1S/C29H37N5O3/c1-36-25-11-10-21(20-26(25)37-2)12-15-30-29(35)22-13-18-34(19-14-22)28-24-9-5-4-8-23(24)27(31-32-28)33-16-6-3-7-17-33/h4-5,8-11,20,22H,3,6-7,12-19H2,1-2H3,(H,30,35)

InChI Key

HZPRULNADSTTCK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14729679

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

503.64

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.022

Distribution Coefficient, logD

4.021

Water Solubility, LogSw

-4.12

Polar Surface Area

67.996

Acid Dissociation Constant (pKa)

13.94

Base Dissociation Constant (pKb)

4.19

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

48.30

C201-1278 in Drug Discovery

Included in Screening Libraries

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

CNS Targets (44014 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with C201-1278 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C201-1278?
Check Price and Availability of C201-1278, 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 C201-1278 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C201-1278
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C201-1278
  • 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 C201-1278 available by request