Y032-4636 Screening compound: N,N-diethyl-N-{2-[(4-phenylpiperazino)carbonyl]phenyl}tetrahydro-1,4(2H)-pyridinedicarboxamide

Y032-4636 Screening compound: N,N-diethyl-N-{2-[(4-phenylpiperazino)carbonyl]phenyl}tetrahydro-1,4(2H)-pyridinedicarboxamide
Y032-4636 Screening compound: N,N-diethyl-N-{2-[(4-phenylpiperazino)carbonyl]phenyl}tetrahydro-1,4(2H)-pyridinedicarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y032-4636
N,N-diethyl-N-{2-[(4-phenylpiperazino)carbonyl]phenyl}tetrahydro-1,4(2H)-pyridinedicarboxamide

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

Y032-4636

Molecular Formula

C28H37N5O3 (C28 H37 N5 O3)

Compound Name

N,N-diethyl-N-{2-[(4-phenylpiperazino)carbonyl]phenyl}tetrahydro-1,4(2H)-pyridinedicarboxamide

IUPAC name

N1N1-diethyl-N4-[2-(4-phenylpiperazine-1-carbonyl)phenyl]piperidine-14-dicarboxamide

SMILES

CCN(CC)C(N(CC1)CCC1C(Nc(cccc1)c1C(N(CC1)CCN1c1ccccc1)=O)=O)=O

InChI

InChI=1S/C28H37N5O3/c1-3-30(4-2)28(36)33-16-14-22(15-17-33)26(34)29-25-13-9-8-12-24(25)27(35)32-20-18-31(19-21-32)23-10-6-5-7-11-23/h5-13,22H,3-4,14-21H2,1-2H3,(H,29,34)

InChI Key

PHNMVAPGTSCENH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15180451

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

491.63

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.382

Distribution Coefficient, logD

3.374

Water Solubility, LogSw

-3.68

Polar Surface Area

60.278

Acid Dissociation Constant (pKa)

9.16

Base Dissociation Constant (pKb)

2.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

46.43

Y032-4636 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 Y032-4636 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y032-4636?
Check Price and Availability of Y032-4636, 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 Y032-4636 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y032-4636
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y032-4636
  • 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 Y032-4636 available by request