G856-8807 Screening compound: 4-phenyl-1-{4-[6-(phenylamino)pyridazin-3-yl]piperazin-1-yl}butan-1-one
Chemical Structure Depiction of ChemDiv screening compound G856-8807
4-phenyl-1-{4-[6-(phenylamino)pyridazin-3-yl]piperazin-1-yl}butan-1-one
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
G856-8807
Molecular Formula
C24H27N5O (C24 H27 N5 O)
Compound Name
4-phenyl-1-{4-[6-(phenylamino)pyridazin-3-yl]piperazin-1-yl}butan-1-one
IUPAC name
4-phenyl-1-{4-[6-(phenylamino)pyridazin-3-yl]piperazin-1-yl}butan-1-one
SMILES
O=C(CCCc1ccccc1)N(CC1)CCN1c(cc1)nnc1Nc1ccccc1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
401.51
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
8.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
4.488
Distribution Coefficient, logD
4.479
Water Solubility, LogSw
-4.34
Polar Surface Area
50.306
Acid Dissociation Constant (pKa)
19.13
Base Dissociation Constant (pKb)
5.74
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
29.20
G856-8807 in Drug Discovery
Included in Screening Libraries
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
GPCR Targeted Library (31838 compounds)
Regenerative Medicine Focused Library (23016 compounds)
Included in 1.7M Stock Database
- Musculoskeletal
- Respiratory tract
- Nervous system
- Congenital
- Skin
- Metabolic
- Endocrine
- Musculoskeletal
- Digestive system
- Hemic and lymphatic
- Cardiovascular
- Skin
- wounds
- GPCR
- Receptor's ligands
References: we are preparing a list of scientific research reports with G856-8807 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)