K284-7617 Screening compound: 5-(6,7-diethoxy-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazolin-3-yl)-N-(2-phenylethyl)pentanamide
Chemical Structure Depiction of ChemDiv screening compound K284-7617
5-(6,7-diethoxy-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazolin-3-yl)-N-(2-phenylethyl)pentanamide
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
K284-7617
Molecular Formula
C25H31N3O4S (C25 H31 N3 O4 S)
Compound Name
5-(6,7-diethoxy-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazolin-3-yl)-N-(2-phenylethyl)pentanamide
IUPAC name
5-(67-diethoxy-4-oxo-2-sulfanylidene-1234-tetrahydroquinazolin-3-yl)-N-(2-phenylethyl)pentanamide
SMILES
CCOc(c(OCC)c1)cc(C(N2CCCCC(NCCc3ccccc3)=O)=O)c1NC2=S
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
469.6
Hydrogen Bond Acceptors Count
8.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
13.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
2.509
Distribution Coefficient, logD
2.487
Water Solubility, LogSw
-3.23
Polar Surface Area
66.030
Acid Dissociation Constant (pKa)
8.69
Base Dissociation Constant (pKb)
3.88
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
40.00
K284-7617 in Drug Discovery
Included in Screening Libraries
Eccentric PPI Library (11937 compounds)
Protein-Protein Interaction Library (218420 compounds)
Included in 1.7M Stock Database
- PPI modulators
- PPI modulators
- Cyclic compounds
References: we are preparing a list of scientific research reports with K284-7617 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)