T403-2715 Screening compound: 1-{6-chloro-[1,2,4]triazolo[4,3-a]pyridin-3-yl}-N-(2,5-dimethoxyphenyl)piperidine-3-carboxamide
Chemical Structure Depiction of ChemDiv screening compound T403-2715
1-{6-chloro-[1,2,4]triazolo[4,3-a]pyridin-3-yl}-N-(2,5-dimethoxyphenyl)piperidine-3-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
T403-2715
Molecular Formula
C20H22ClN5O3 (C20 H22 ClN5 O3)
Compound Name
1-{6-chloro-[1,2,4]triazolo[4,3-a]pyridin-3-yl}-N-(2,5-dimethoxyphenyl)piperidine-3-carboxamide
IUPAC name
1-{6-chloro-[124]triazolo[43-a]pyridin-3-yl}-N-(25-dimethoxyphenyl)piperidine-3-carboxamide
SMILES
COc(cc1)cc(NC(C(CCC2)CN2c2nnc(cc3)n2cc3Cl)=O)c1OC
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
415.88
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
8
Partition Coefficient, logP
2.867
Distribution Coefficient, logD
2.864
Water Solubility, LogSw
-3.51
Polar Surface Area
62.236
Acid Dissociation Constant (pKa)
9.58
Base Dissociation Constant (pKb)
2.10
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
35.00
T403-2715 in Drug Discovery
Included in Screening Libraries
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
Nonpeptide Peptidomimetics PPI Library (18997 compounds)
Protein-Protein Interaction Library (218420 compounds)
Serine Proteases Inhibitors Library (32732 compounds)
SmartTM Library (51161 compounds)
Beyond the Flatland Library sp3 enriched (92988 compounds)
Included in 1.7M Stock Database
- PPI modulators
- PPI modulators
- Mimetics
- Cyclic compounds
- Infections
- Cancer
- Musculoskeletal
- Digestive system
- Respiratory tract
- Male
- Female
- Cardiovascular
- Skin
- Metabolic
- Immune system
- Proteases
References: we are preparing a list of scientific research reports with T403-2715 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)