K284-4563 Screening compound: N-[3-(morpholin-4-yl)propyl]-4-oxo-2-[(2-oxo-2-phenylethyl)sulfanyl]-3-[(oxolan-2-yl)methyl]-3,4-dihydroquinazoline-7-carboxamide

K284-4563 Screening compound: N-[3-(morpholin-4-yl)propyl]-4-oxo-2-[(2-oxo-2-phenylethyl)sulfanyl]-3-[(oxolan-2-yl)methyl]-3,4-dihydroquinazoline-7-carboxamide
K284-4563 Screening compound: N-[3-(morpholin-4-yl)propyl]-4-oxo-2-[(2-oxo-2-phenylethyl)sulfanyl]-3-[(oxolan-2-yl)methyl]-3,4-dihydroquinazoline-7-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K284-4563
N-[3-(morpholin-4-yl)propyl]-4-oxo-2-[(2-oxo-2-phenylethyl)sulfanyl]-3-[(oxolan-2-yl)methyl]-3,4-dihydroquinazoline-7-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

K284-4563

Molecular Formula

C29H34N4O5S (C29 H34 N4 O5 S)

Compound Name

N-[3-(morpholin-4-yl)propyl]-4-oxo-2-[(2-oxo-2-phenylethyl)sulfanyl]-3-[(oxolan-2-yl)methyl]-3,4-dihydroquinazoline-7-carboxamide

IUPAC name

N-[3-(morpholin-4-yl)propyl]-4-oxo-2-[(2-oxo-2-phenylethyl)sulfanyl]-3-[(oxolan-2-yl)methyl]-34-dihydroquinazoline-7-carboxamide

SMILES

O=C(CSC(N1CC2OCCC2)=Nc(cc(cc2)C(NCCCN3CCOCC3)=O)c2C1=O)c1ccccc1

InChI

InChI=1S/C29H34N4O5S/c34-26(21-6-2-1-3-7-21)20-39-29-31-25-18-22(27(35)30-11-5-12-32-13-16-37-17-14-32)9-10-24(25)28(36)33(29)19-23-8-4-15-38-23/h1-3,6-7,9-10,18,23H,4-5,8,11-17,19-20H2,(H,30,35)/t23-/m1/s1

InChI Key

SVVXEZLOVBRBOU-HSZRJFAPSA-N

MDL Number (MFCD)

MFCD15088349

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

550.68

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.644

Distribution Coefficient, logD

1.256

Water Solubility, LogSw

-2.81

Polar Surface Area

83.818

Acid Dissociation Constant (pKa)

13.94

Base Dissociation Constant (pKb)

7.56

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

44.80

K284-4563 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Eccentric PPI Library (11937 compounds)

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with K284-4563 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K284-4563?
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What is the minimum amount of K284-4563 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K284-4563
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K284-4563
  • 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 K284-4563 available by request