K279-0819 Screening compound: 3-(5-{[2-(4-FLUOROANILINO)-2-OXOETHYL]SULFANYL}-2-OXO-2,3-DIHYDROIMIDAZO[1,2-C]QUINAZOLIN-3-YL)-N~1~-(2-METHOXYBENZYL)PROPANAMIDE
Chemical Structure Depiction of ChemDiv screening compound K279-0819
3-(5-{[2-(4-FLUOROANILINO)-2-OXOETHYL]SULFANYL}-2-OXO-2,3-DIHYDROIMIDAZO[1,2-C]QUINAZOLIN-3-YL)-N~1~-(2-METHOXYBENZYL)PROPANAMIDE
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
K279-0819
Molecular Formula
C29H26FN5O4S (C29 H26 FN5 O4 S)
Compound Name
3-(5-{[2-(4-FLUOROANILINO)-2-OXOETHYL]SULFANYL}-2-OXO-2,3-DIHYDROIMIDAZO[1,2-C]QUINAZOLIN-3-YL)-N~1~-(2-METHOXYBENZYL)PROPANAMIDE
IUPAC name
n/a
SMILES
COc1c(CNC(CCC2N3C(SCC(Nc(cc4)ccc4F)=O)=Nc(cccc4)c4C3=NC2=O)=O)cccc1
InChI Key
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
559.62
Hydrogen Bond Acceptors Count
10.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
12.00
Number of Nitrogen and Oxygen Atoms
9
Partition Coefficient, logP
3.319
Distribution Coefficient, logD
3.318
Water Solubility, LogSw
-3.82
Polar Surface Area
90.403
Acid Dissociation Constant (pKa)
10.29
Base Dissociation Constant (pKb)
3.90
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
20.70
K279-0819 in Drug Discovery
Included in Screening Libraries
Eccentric PPI Library (11937 compounds)
Protein-Protein Interaction Library (218420 compounds)
Selective Target Activity Profiling Library (14702 compounds)
ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)
Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)
Included in 1.7M Stock Database
- PPI modulators
- PPI modulators
- Cyclic compounds
- Cancer
- Nervous system
- Male
- Female
- Hemic and lymphatic
- Skin
- Endocrine
- Phosphatases
References: we are preparing a list of scientific research reports with K279-0819 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)