G796-0263 Screening compound: N-({1-[(4-chlorophenyl)methyl]piperidin-4-yl}methyl)-1-(6-methyl-1H-1,3-benzodiazol-2-yl)piperidine-4-carboxamide
Chemical Structure Depiction of ChemDiv screening compound G796-0263
N-({1-[(4-chlorophenyl)methyl]piperidin-4-yl}methyl)-1-(6-methyl-1H-1,3-benzodiazol-2-yl)piperidine-4-carboxamide
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
G796-0263
Molecular Formula
C27H34ClN5O (C27 H34 ClN5 O)
Compound Name
N-({1-[(4-chlorophenyl)methyl]piperidin-4-yl}methyl)-1-(6-methyl-1H-1,3-benzodiazol-2-yl)piperidine-4-carboxamide
IUPAC name
N-({1-[(4-chlorophenyl)methyl]piperidin-4-yl}methyl)-1-(6-methyl-1H-13-benzodiazol-2-yl)piperidine-4-carboxamide
SMILES
Cc(cc1)cc([nH]2)c1nc2N(CC1)CCC1C(NCC1CCN(Cc(cc2)ccc2Cl)CC1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
480.05
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
7.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
4.672
Distribution Coefficient, logD
3.036
Water Solubility, LogSw
-4.71
Polar Surface Area
50.055
Acid Dissociation Constant (pKa)
14.15
Base Dissociation Constant (pKb)
9.03
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
48.10
G796-0263 in Drug Discovery
Included in Screening Libraries
3D-Diversity Natural-Product-Like Library (18102 compounds)
Anti-Inflammatory Library (24602 compounds)
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
Chelators targeting matrix metalloproteinases library (8930 compounds)
Protein-Protein Interaction Library (218420 compounds)
Serine Proteases Inhibitors Library (32732 compounds)
Chemokine Receptor-Targeted Library (18382 compounds)
Included in 1.7M Stock Database
- 3D
- Immune system
- Nervous system
- Cancer
- Digestive system
- Cardiovascular
- Infections
- Cancer
- Musculoskeletal
- Digestive system
- Respiratory tract
- Male
- Female
- Cardiovascular
- Skin
- Metabolic
- Immune system
- Immune system
- Proteases
- Proteases
- PPI modulators
- Receptor's ligands
References: we are preparing a list of scientific research reports with G796-0263 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)