T652-0250 Screening compound: N~6~-cycloheptyl-3-(4-fluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-6-carboxamide
Chemical Structure Depiction of ChemDiv screening compound T652-0250
N~6~-cycloheptyl-3-(4-fluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-6-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
T652-0250
Molecular Formula
C21H26FN3O (C21 H26 FN3 O)
Compound Name
N~6~-cycloheptyl-3-(4-fluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-6-carboxamide
IUPAC name
N-cycloheptyl-3-(4-fluorophenyl)-5H6H7H8H-imidazo[12-a]pyridine-6-carboxamide
SMILES
O=C(C1Cn2c(-c(cc3)ccc3F)cnc2CC1)NC1CCCCCC1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
355.46
Hydrogen Bond Acceptors Count
3.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
4.00
Number of Nitrogen and Oxygen Atoms
4
Partition Coefficient, logP
4.358
Distribution Coefficient, logD
3.467
Water Solubility, LogSw
-4.19
Polar Surface Area
35.857
Acid Dissociation Constant (pKa)
14.17
Base Dissociation Constant (pKb)
8.23
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
52.38
T652-0250 in Drug Discovery
Included in Screening Libraries
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
GPCR Targeted Library (31838 compounds)
PPI Helix Turn 3D-Mimetics Library (71298 compounds)
Protein-Protein Interaction Library (218420 compounds)
Alpha-Helix Mimetics Library (25899 compounds)
Beyond the Flatland Library sp3 enriched (92988 compounds)
Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)
Inhibitors of beta-Catenin Signaling (7445 compounds)
MEF2-HDAC (class II) Modulators Library (5147 compounds)
SH2 PTB Focused Library (6188 compounds)
Included in 1.7M Stock Database
- Musculoskeletal
- Respiratory tract
- Nervous system
- Congenital
- Skin
- Metabolic
- Endocrine
- Cancer
- Digestive system
- Female
- Hemic and lymphatic
- Metabolic
- Immune system
- Cancer
- Musculoskeletal
- Female
- Hemic and lymphatic
- Cardiovascular
- GPCR
- Others
- Receptor's ligands
- PPI modulators
- PPI modulators
- PPI modulators
- PPI modulators
- Epigenetic
- Mimetics
- Mimetics
- Cyclic compounds
References: we are preparing a list of scientific research reports with T652-0250 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)