G008-2558 Screening compound: N-[3-(4-benzylpiperazin-1-yl)propyl]-2-methyl-5-(3-methyl-1,2-oxazol-5-yl)benzene-1-sulfonamide
Chemical Structure Depiction of ChemDiv screening compound G008-2558
N-[3-(4-benzylpiperazin-1-yl)propyl]-2-methyl-5-(3-methyl-1,2-oxazol-5-yl)benzene-1-sulfonamide
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
G008-2558
Molecular Formula
C25H32N4O3S (C25 H32 N4 O3 S)
Compound Name
N-[3-(4-benzylpiperazin-1-yl)propyl]-2-methyl-5-(3-methyl-1,2-oxazol-5-yl)benzene-1-sulfonamide
IUPAC name
N-[3-(4-benzylpiperazin-1-yl)propyl]-2-methyl-5-(3-methyl-12-oxazol-5-yl)benzene-1-sulfonamide
SMILES
Cc1noc(-c2cc(S(NCCCN3CCN(Cc4ccccc4)CC3)(=O)=O)c(C)cc2)c1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
468.62
Hydrogen Bond Acceptors Count
9.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
9.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
3.563
Distribution Coefficient, logD
3.102
Water Solubility, LogSw
-3.64
Polar Surface Area
70.703
Acid Dissociation Constant (pKa)
10.49
Base Dissociation Constant (pKb)
7.68
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
40.00
G008-2558 in Drug Discovery
Included in Screening Libraries
3D-Pharmacophore Based Diversity Library (49813 compounds)
GPCR Targeted Library (31838 compounds)
Included in 1.7M Stock Database
- Musculoskeletal
- Respiratory tract
- Nervous system
- Congenital
- Skin
- Metabolic
- Endocrine
- GPCR
- Receptor's ligands
References: we are preparing a list of scientific research reports with G008-2558 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)