C600-0056 Screening compound: N-(3-methoxypropyl)-3-(N'-{2-phenyl-[1,2,4]triazolo[1,5-c]quinazolin-5-yl}hydrazinecarbonyl)propanamide
Chemical Structure Depiction of ChemDiv screening compound C600-0056
N-(3-methoxypropyl)-3-(N'-{2-phenyl-[1,2,4]triazolo[1,5-c]quinazolin-5-yl}hydrazinecarbonyl)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
C600-0056
Molecular Formula
C23H25N7O3 (C23 H25 N7 O3)
Compound Name
N-(3-methoxypropyl)-3-(N'-{2-phenyl-[1,2,4]triazolo[1,5-c]quinazolin-5-yl}hydrazinecarbonyl)propanamide
IUPAC name
N-(3-methoxypropyl)-3-(N'-{2-phenyl-[124]triazolo[15-c]quinazolin-5-yl}hydrazinecarbonyl)propanamide
SMILES
COCCCNC(CCC(NNc1nc(cccc2)c2c2nc(-c3ccccc3)nn12)=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
447.5
Hydrogen Bond Acceptors Count
8.00
Hydrogen Bond Donors Count
3.00
Rotatable Bond Count
12.00
Number of Nitrogen and Oxygen Atoms
10
Partition Coefficient, logP
1.627
Distribution Coefficient, logD
1.327
Water Solubility, LogSw
-2.18
Polar Surface Area
101.125
Acid Dissociation Constant (pKa)
12.86
Base Dissociation Constant (pKb)
7.40
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
26.10
C600-0056 in Drug Discovery
Included in Screening Libraries
CNS Annotated Library (688 compounds)
Chelators targeting matrix metalloproteinases library (8930 compounds)
Human GPCR Annotated Library (5539 compounds)
ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)
Included in 1.7M Stock Database
- Cancer
- Digestive system
- Cardiovascular
- Proteases
References: we are preparing a list of scientific research reports with C600-0056 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)