K284-7596 Screening compound: 2-[(4-oxo-3-{2-[4-oxo-2-({[(1,3-thiazol-2-yl)carbamoyl]methyl}sulfanyl)-3,4-dihydroquinazolin-3-yl]ethyl}-3,4-dihydroquinazolin-2-yl)sulfanyl]-N-(1,3-thiazol-2-yl)acetamide
Chemical Structure Depiction of ChemDiv screening compound K284-7596
2-[(4-oxo-3-{2-[4-oxo-2-({[(1,3-thiazol-2-yl)carbamoyl]methyl}sulfanyl)-3,4-dihydroquinazolin-3-yl]ethyl}-3,4-dihydroquinazolin-2-yl)sulfanyl]-N-(1,3-thiazol-2-yl)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
K284-7596
Molecular Formula
C28H22N8O4S4 (C28 H22 N8 O4 S4)
Compound Name
2-[(4-oxo-3-{2-[4-oxo-2-({[(1,3-thiazol-2-yl)carbamoyl]methyl}sulfanyl)-3,4-dihydroquinazolin-3-yl]ethyl}-3,4-dihydroquinazolin-2-yl)sulfanyl]-N-(1,3-thiazol-2-yl)acetamide
IUPAC name
2-[(4-oxo-3-{2-[4-oxo-2-({[(13-thiazol-2-yl)carbamoyl]methyl}sulfanyl)-34-dihydroquinazolin-3-yl]ethyl}-34-dihydroquinazolin-2-yl)sulfanyl]-N-(13-thiazol-2-yl)acetamide
SMILES
O=C(CSC(N1CCN2C(SCC(Nc3nccs3)=O)=Nc(cccc3)c3C2=O)=Nc(cccc2)c2C1=O)Nc1nccs1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
662.8
Hydrogen Bond Acceptors Count
14.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
13.00
Number of Nitrogen and Oxygen Atoms
12
Partition Coefficient, logP
3.004
Distribution Coefficient, logD
3.003
Water Solubility, LogSw
-3.68
Polar Surface Area
118.788
Acid Dissociation Constant (pKa)
10.55
Base Dissociation Constant (pKb)
0.37
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
14.30
K284-7596 in Drug Discovery
Included in Screening Libraries
Eccentric PPI Library (11937 compounds)
Protein-Protein Interaction Library (218420 compounds)
Therapeutical Diversity Annotated Library (7563 compounds)
Included in 1.7M Stock Database
- PPI modulators
- PPI modulators
- Cyclic compounds
References: we are preparing a list of scientific research reports with K284-7596 chemical compound. It will be published here after verification.
Frequently Asked Questions
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Available from 1 mg in Glass Vials or 96-tube racks.
ChemDiv sends parcels with Express services (UPS, WC).
- 1–2 days for small orders
- 2–4 weeks for large selections
- 0.5–50 mg of dry powder sample in single glass vials, custom vials
- DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)