Y031-1482 Screening compound: 2-phenyl-N-[2-(4-phenylpiperazine-1-carbonyl)phenyl]butanamide

Y031-1482 Screening compound: 2-phenyl-N-[2-(4-phenylpiperazine-1-carbonyl)phenyl]butanamide
Y031-1482 Screening compound: 2-phenyl-N-[2-(4-phenylpiperazine-1-carbonyl)phenyl]butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y031-1482
2-phenyl-N-[2-(4-phenylpiperazine-1-carbonyl)phenyl]butanamide

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

Y031-1482

Molecular Formula

C27H29N3O2 (C27 H29 N3 O2)

Compound Name

2-phenyl-N-[2-(4-phenylpiperazine-1-carbonyl)phenyl]butanamide

IUPAC name

2-phenyl-N-[2-(4-phenylpiperazine-1-carbonyl)phenyl]butanamide

SMILES

CCC(C(Nc(cccc1)c1C(N(CC1)CCN1c1ccccc1)=O)=O)c1ccccc1

InChI

InChI=1S/C27H29N3O2/c1-2-23(21-11-5-3-6-12-21)26(31)28-25-16-10-9-15-24(25)27(32)30-19-17-29(18-20-30)22-13-7-4-8-14-22/h3-16,23H,2,17-20H2,1H3,(H,28,31)/t23-/m1/s1

InChI Key

LVKBBNPLRJQFRK-HSZRJFAPSA-N

MDL Number (MFCD)

MFCD07066352

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

427.55

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.818

Distribution Coefficient, logD

4.799

Water Solubility, LogSw

-4.49

Polar Surface Area

42.540

Acid Dissociation Constant (pKa)

8.74

Base Dissociation Constant (pKb)

5.75

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

25.90

Y031-1482 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 Y031-1482 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y031-1482?
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What is the minimum amount of Y031-1482 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y031-1482
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y031-1482
  • 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 Y031-1482 available by request