C200-2373 Screening compound: 3-{4-benzyl-5-oxo-4H,5H-[1,2,4]triazolo[4,3-a]quinazolin-1-yl}-N-(1-benzylpiperidin-4-yl)propanamide
Chemical Structure Depiction of ChemDiv screening compound C200-2373
3-{4-benzyl-5-oxo-4H,5H-[1,2,4]triazolo[4,3-a]quinazolin-1-yl}-N-(1-benzylpiperidin-4-yl)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
C200-2373
Molecular Formula
C31H32N6O2 (C31 H32 N6 O2)
Compound Name
3-{4-benzyl-5-oxo-4H,5H-[1,2,4]triazolo[4,3-a]quinazolin-1-yl}-N-(1-benzylpiperidin-4-yl)propanamide
IUPAC name
3-{4-benzyl-5-oxo-4H5H-[124]triazolo[43-a]quinazolin-1-yl}-N-(1-benzylpiperidin-4-yl)propanamide
SMILES
O=C(CCc(n1-c2c3cccc2)nnc1N(Cc1ccccc1)C3=O)NC1CCN(Cc2ccccc2)CC1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
520.63
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
9.00
Number of Nitrogen and Oxygen Atoms
8
Partition Coefficient, logP
3.148
Distribution Coefficient, logD
1.590
Water Solubility, LogSw
-3.62
Polar Surface Area
67.444
Acid Dissociation Constant (pKa)
16.14
Base Dissociation Constant (pKb)
8.95
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
29.00
C200-2373 in Drug Discovery
Included in Screening Libraries
GPCR Targeted Library (31838 compounds)
Protein-Protein Interaction Library (218420 compounds)
Targeted Diversity Library (40567 compounds)
Chemokine Receptor-Targeted Library (18382 compounds)
Included in 1.7M Stock Database
- Musculoskeletal
- Respiratory tract
- Nervous system
- Congenital
- Skin
- Metabolic
- Endocrine
- Immune system
- GPCR
- Receptor's ligands
- PPI modulators
- Receptor's ligands
References: we are preparing a list of scientific research reports with C200-2373 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)