G889-1222 Screening compound: 5-(2-chlorobenzamido)-2-{4-[2-(piperidin-1-yl)ethyl]piperidin-1-yl}benzoic acid
Chemical Structure Depiction of ChemDiv screening compound G889-1222
5-(2-chlorobenzamido)-2-{4-[2-(piperidin-1-yl)ethyl]piperidin-1-yl}benzoic acid
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
G889-1222
Molecular Formula
C26H32ClN3O3 (C26 H32 ClN3 O3)
Compound Name
5-(2-chlorobenzamido)-2-{4-[2-(piperidin-1-yl)ethyl]piperidin-1-yl}benzoic acid
IUPAC name
5-(2-chlorobenzamido)-2-{4-[2-(piperidin-1-yl)ethyl]piperidin-1-yl}benzoic acid
SMILES
OC(c(cc(cc1)NC(c(cccc2)c2Cl)=O)c1N1CCC(CCN2CCCCC2)CC1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
CF3COOH
Molecular Weight
470.01
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
8.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
5.372
Distribution Coefficient, logD
5.372
Water Solubility, LogSw
-5.44
Polar Surface Area
58.600
Acid Dissociation Constant (pKa)
5.15
Base Dissociation Constant (pKb)
9.14
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
46.20
G889-1222 in Drug Discovery
Included in Screening Libraries
3D-Diversity Natural-Product-Like Library (18102 compounds)
GPCR Targeted Library (31838 compounds)
Macl-GPIb alpha Interaction Library (22969 compounds)
Neurotransmitter Transporter Inhibitors Library (11024 compounds)
Protein-Protein Interaction Library (218420 compounds)
Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)
Included in 1.7M Stock Database
- 3D
- Musculoskeletal
- Respiratory tract
- Nervous system
- Congenital
- Skin
- Metabolic
- Endocrine
- Hemic and lymphatic
- Cardiovascular
- Nervous system
- Cancer
- Nervous system
- Male
- Female
- Hemic and lymphatic
- Skin
- Endocrine
- GPCR
- GPCR
- Ion Channels
- Phosphatases
- Receptor's ligands
- PPI modulators
References: we are preparing a list of scientific research reports with G889-1222 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)