K284-4504 Screening compound: N-[(furan-2-yl)methyl]-2-[(4-oxo-3-{[4-(4-phenylpiperazine-1-carbonyl)cyclohexyl]methyl}-3,4-dihydroquinazolin-2-yl)sulfanyl]acetamide

K284-4504 Screening compound: N-[(furan-2-yl)methyl]-2-[(4-oxo-3-{[4-(4-phenylpiperazine-1-carbonyl)cyclohexyl]methyl}-3,4-dihydroquinazolin-2-yl)sulfanyl]acetamide
K284-4504 Screening compound: N-[(furan-2-yl)methyl]-2-[(4-oxo-3-{[4-(4-phenylpiperazine-1-carbonyl)cyclohexyl]methyl}-3,4-dihydroquinazolin-2-yl)sulfanyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K284-4504
N-[(furan-2-yl)methyl]-2-[(4-oxo-3-{[4-(4-phenylpiperazine-1-carbonyl)cyclohexyl]methyl}-3,4-dihydroquinazolin-2-yl)sulfanyl]acetamide

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

K284-4504

Molecular Formula

C33H37N5O4S (C33 H37 N5 O4 S)

Compound Name

N-[(furan-2-yl)methyl]-2-[(4-oxo-3-{[4-(4-phenylpiperazine-1-carbonyl)cyclohexyl]methyl}-3,4-dihydroquinazolin-2-yl)sulfanyl]acetamide

IUPAC name

N-[(furan-2-yl)methyl]-2-[(4-oxo-3-{[4-(4-phenylpiperazine-1-carbonyl)cyclohexyl]methyl}-34-dihydroquinazolin-2-yl)sulfanyl]acetamide

SMILES

O=C(CSC(N1CC(CC2)CCC2C(N(CC2)CCN2c2ccccc2)=O)=Nc(cccc2)c2C1=O)NCc1ccco1

InChI

InChI=1S/C33H37N5O4S/c39-30(34-21-27-9-6-20-42-27)23-43-33-35-29-11-5-4-10-28(29)32(41)38(33)22-24-12-14-25(15-13-24)31(40)37-18-16-36(17-19-37)26-7-2-1-3-8-26/h1-11,20,24-25H,12-19,21-23H2,(H,34,39)

InChI Key

BGVCIPFPPRYUPA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15088304

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

599.75

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.901

Distribution Coefficient, logD

4.901

Water Solubility, LogSw

-4.81

Polar Surface Area

78.092

Acid Dissociation Constant (pKa)

13.33

Base Dissociation Constant (pKb)

3.55

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

39.40

K284-4504 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with K284-4504 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K284-4504?
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What is the minimum amount of K284-4504 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K284-4504
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K284-4504
  • 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 K284-4504 available by request