L227-0452 Screening compound: 1-[2-(4-fluorophenyl)-5-methylpyrazolo[1,5-a]pyrimidin-7-yl]-N-[(3-methylphenyl)methyl]piperidine-4-carboxamide
Chemical Structure Depiction of ChemDiv screening compound L227-0452
1-[2-(4-fluorophenyl)-5-methylpyrazolo[1,5-a]pyrimidin-7-yl]-N-[(3-methylphenyl)methyl]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
L227-0452
Molecular Formula
C27H28FN5O (C27 H28 FN5 O)
Compound Name
1-[2-(4-fluorophenyl)-5-methylpyrazolo[1,5-a]pyrimidin-7-yl]-N-[(3-methylphenyl)methyl]piperidine-4-carboxamide
IUPAC name
1-[2-(4-fluorophenyl)-5-methylpyrazolo[15-a]pyrimidin-7-yl]-N-[(3-methylphenyl)methyl]piperidine-4-carboxamide
SMILES
Cc1cccc(CNC(C(CC2)CCN2c2cc(C)nc3cc(-c(cc4)ccc4F)nn23)=O)c1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
457.55
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
5.149
Distribution Coefficient, logD
2.994
Water Solubility, LogSw
-5.06
Polar Surface Area
46.147
Acid Dissociation Constant (pKa)
12.56
Base Dissociation Constant (pKb)
9.55
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
29.60
L227-0452 in Drug Discovery
Included in Screening Libraries
CORONAVIRUS Library (20774 compounds)
Macl-GPIb alpha Interaction Library (22969 compounds)
PLpro Library (6343 compounds)
Protein Kinases Inhibitors Library (36801 compounds)
Included in 1.7M Stock Database
- Antiviral
- Infections
- Immune system
- Hemic and lymphatic
- Cardiovascular
- Antiviral
- Infections
- Immune system
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Nervous system
- Hemic and lymphatic
- Cardiovascular
- Kinases
References: we are preparing a list of scientific research reports with L227-0452 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)