D463-0205 Screening compound: 1-[5-tert-butyl-3-(4-fluorophenyl)-2-methylpyrazolo[1,5-a]pyrimidin-7-yl]piperidine
Chemical Structure Depiction of ChemDiv screening compound D463-0205
1-[5-tert-butyl-3-(4-fluorophenyl)-2-methylpyrazolo[1,5-a]pyrimidin-7-yl]piperidine
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
D463-0205
Molecular Formula
C22H27FN4 (C22 H27 FN4)
Compound Name
1-[5-tert-butyl-3-(4-fluorophenyl)-2-methylpyrazolo[1,5-a]pyrimidin-7-yl]piperidine
IUPAC name
1-[5-tert-butyl-3-(4-fluorophenyl)-2-methylpyrazolo[15-a]pyrimidin-7-yl]piperidine
SMILES
CC(C)(C)c(cc(n1nc2C)N3CCCCC3)nc1c2-c(cc1)ccc1F
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
366.48
Hydrogen Bond Acceptors Count
2.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
3.00
Number of Nitrogen and Oxygen Atoms
4
Partition Coefficient, logP
5.700
Distribution Coefficient, logD
3.895
Water Solubility, LogSw
-5.72
Polar Surface Area
23.050
Acid Dissociation Constant (pKa)
25.34
Base Dissociation Constant (pKb)
9.20
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
45.50
D463-0205 in Drug Discovery
Included in Screening Libraries
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
Protein Kinases Inhibitors Library (36801 compounds)
Targeted Diversity Library (40567 compounds)
Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)
Included in 1.7M Stock Database
- Eye
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Nervous system
- Hemic and lymphatic
- Cardiovascular
- Cancer
- Nervous system
- Male
- Female
- Hemic and lymphatic
- Skin
- Endocrine
- GPCR
- Ion Channels
- Kinases
- Phosphatases
- Receptor's ligands
References: we are preparing a list of scientific research reports with D463-0205 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)