G395-0574 Screening compound: 3-[6-(benzylamino)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]-N-[4-(furan-2-yl)butan-2-yl]propanamide
Chemical Structure Depiction of ChemDiv screening compound G395-0574
3-[6-(benzylamino)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]-N-[4-(furan-2-yl)butan-2-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
G395-0574
Molecular Formula
C23H26N6O2 (C23 H26 N6 O2)
Compound Name
3-[6-(benzylamino)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]-N-[4-(furan-2-yl)butan-2-yl]propanamide
IUPAC name
3-[6-(benzylamino)-[124]triazolo[43-b]pyridazin-3-yl]-N-[4-(furan-2-yl)butan-2-yl]propanamide
SMILES
CC(CCc1ccco1)NC(CCc1nnc(cc2)n1nc2NCc1ccccc1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
418.5
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
11.00
Number of Nitrogen and Oxygen Atoms
8
Partition Coefficient, logP
2.735
Distribution Coefficient, logD
2.735
Water Solubility, LogSw
-3.03
Polar Surface Area
75.837
Acid Dissociation Constant (pKa)
15.04
Base Dissociation Constant (pKb)
1.64
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
30.40
G395-0574 in Drug Discovery
Included in Screening Libraries
3D-Biodiversity Library (27607 compounds)
ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)
Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)
Included in 1.7M Stock Database
- 3D
References: we are preparing a list of scientific research reports with G395-0574 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)