L631-0228 Screening compound: N-[(2-methoxyphenyl)methyl]-1-[1-methyl-5-(2-methylpropanoyl)-1H,4H,5H,6H,7H-pyrazolo[4,3-c]pyridine-3-carbonyl]piperidine-4-carboxamide
Chemical Structure Depiction of ChemDiv screening compound L631-0228
N-[(2-methoxyphenyl)methyl]-1-[1-methyl-5-(2-methylpropanoyl)-1H,4H,5H,6H,7H-pyrazolo[4,3-c]pyridine-3-carbonyl]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
L631-0228
Molecular Formula
C26H35N5O4 (C26 H35 N5 O4)
Compound Name
N-[(2-methoxyphenyl)methyl]-1-[1-methyl-5-(2-methylpropanoyl)-1H,4H,5H,6H,7H-pyrazolo[4,3-c]pyridine-3-carbonyl]piperidine-4-carboxamide
IUPAC name
N-[(2-methoxyphenyl)methyl]-1-[1-methyl-5-(2-methylpropanoyl)-1H4H5H6H7H-pyrazolo[43-c]pyridine-3-carbonyl]piperidine-4-carboxamide
SMILES
CC(C)C(N(CC1)Cc2c1n(C)nc2C(N(CC1)CCC1C(NCc(cccc1)c1OC)=O)=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
481.6
Hydrogen Bond Acceptors Count
8.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
9.00
Number of Nitrogen and Oxygen Atoms
9
Partition Coefficient, logP
1.253
Distribution Coefficient, logD
1.253
Water Solubility, LogSw
-2.12
Polar Surface Area
80.530
Acid Dissociation Constant (pKa)
12.56
Base Dissociation Constant (pKb)
10.87
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
53.80
L631-0228 in Drug Discovery
Included in Screening Libraries
Anticancer Library (62698 compounds)
Cysteine Proteases Inhibitors Library (7839 compounds)
Hsp90-Targeted Library (11355 compounds)
MCL1 Targeted Library (12200 compounds)
Macl-GPIb alpha Interaction Library (22969 compounds)
PPI Inhibitors Tripeptide Mimetics (23972 compounds)
Protein Kinases Inhibitors Library (36801 compounds)
SmartTM Library (51161 compounds)
Adenosine Receptors Targeted Library (19896 compounds)
Peptidomimetic Library (37031 compounds)
Included in 1.7M Stock Database
- Cancer
- Infections
- Cancer
- Musculoskeletal
- Digestive system
- Nervous system
- Cardiovascular
- Skin
- Metabolic
- Endocrine
- Immune system
- Cancer
- Digestive system
- Respiratory tract
- Male
- Female
- Hemic and lymphatic
- Immune system
- Digestive system
- Respiratory tract
- Male
- Female
- Hemic and lymphatic
- Hemic and lymphatic
- Cardiovascular
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Nervous system
- Hemic and lymphatic
- Cardiovascular
- Cancer
- Digestive system
- Respiratory tract
- Nervous system
- Eye
- Cardiovascular
- Proteases
- Kinases
- GPCR
- PPI modulators
- Receptor's ligands
- PPI modulators
- Mimetics
- Mimetics
References: we are preparing a list of scientific research reports with L631-0228 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)