F612-0159 Screening compound: 2-[1-(4-ethylphenyl)-5-methyl-1H-pyrazol-4-yl]-N-[(pyridin-3-yl)methyl]quinoline-4-carboxamide
Chemical Structure Depiction of ChemDiv screening compound F612-0159
2-[1-(4-ethylphenyl)-5-methyl-1H-pyrazol-4-yl]-N-[(pyridin-3-yl)methyl]quinoline-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
F612-0159
Molecular Formula
C28H25N5O (C28 H25 N5 O)
Compound Name
2-[1-(4-ethylphenyl)-5-methyl-1H-pyrazol-4-yl]-N-[(pyridin-3-yl)methyl]quinoline-4-carboxamide
IUPAC name
2-[1-(4-ethylphenyl)-5-methyl-1H-pyrazol-4-yl]-N-[(pyridin-3-yl)methyl]quinoline-4-carboxamide
SMILES
CCc(cc1)ccc1-n1ncc(-c2nc3ccccc3c(C(NCc3cnccc3)=O)c2)c1C
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
447.54
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
7.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
5.419
Distribution Coefficient, logD
5.419
Water Solubility, LogSw
-5.41
Polar Surface Area
56.294
Acid Dissociation Constant (pKa)
14.19
Base Dissociation Constant (pKb)
3.76
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
14.30
F612-0159 in Drug Discovery
Included in Screening Libraries
Anticancer Library (62698 compounds)
Antifungal Library (16415 compounds)
PI3K-Targeted Library (17255 compounds)
Targeted Diversity Library (40567 compounds)
Included in 1.7M Stock Database
- Cancer
- Infections
- Immune system
- animal
- Nervous system
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Male
- Female
- Hemic and lymphatic
- Skin
- Agro
- Kinases
References: we are preparing a list of scientific research reports with F612-0159 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)