E543-0714 Screening compound: 3-(4-methoxyphenyl)-5-oxo-N-[3-(propan-2-yloxy)propyl]-4H,5H-[1,2,3]triazolo[1,5-a]quinazoline-8-carboxamide
Chemical Structure Depiction of ChemDiv screening compound E543-0714
3-(4-methoxyphenyl)-5-oxo-N-[3-(propan-2-yloxy)propyl]-4H,5H-[1,2,3]triazolo[1,5-a]quinazoline-8-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
E543-0714
Molecular Formula
C23H25N5O4 (C23 H25 N5 O4)
Compound Name
3-(4-methoxyphenyl)-5-oxo-N-[3-(propan-2-yloxy)propyl]-4H,5H-[1,2,3]triazolo[1,5-a]quinazoline-8-carboxamide
IUPAC name
3-(4-methoxyphenyl)-5-oxo-N-[3-(propan-2-yloxy)propyl]-4H5H-[123]triazolo[15-a]quinazoline-8-carboxamide
SMILES
CC(C)OCCCNC(c(cc1)cc(-n2nnc(-c(cc3)ccc3OC)c2N2)c1C2=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
435.48
Hydrogen Bond Acceptors Count
8.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
9.00
Number of Nitrogen and Oxygen Atoms
9
Partition Coefficient, logP
2.134
Distribution Coefficient, logD
2.134
Water Solubility, LogSw
-3.18
Polar Surface Area
89.502
Acid Dissociation Constant (pKa)
11.08
Base Dissociation Constant (pKb)
-2.79
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
30.40
E543-0714 in Drug Discovery
Included in Screening Libraries
Allosteric Kinases Inhibitors Library (23117 compounds)
Anticancer Library (62698 compounds)
Antiviral HBV Library (10007 compounds)
Antiviral Library (67538 compounds)
Protein-Protein Interaction Library (218420 compounds)
Chemokine Receptor-Targeted Library (18382 compounds)
Included in 1.7M Stock Database
- Cancer
- Female
- Congenital
- Skin
- Cancer
- Antiviral
- Infections
- Immune system
- Antiviral
- Infections
- Immune system
- Immune system
- Kinases
- PPI modulators
- Receptor's ligands
References: we are preparing a list of scientific research reports with E543-0714 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)