M124-0047 Screening compound: methyl 4-oxo-3-phenyl-2-[4-(pyridin-2-yl)piperazin-1-yl]-3,4-dihydroquinazoline-7-carboxylate
Chemical Structure Depiction of ChemDiv screening compound M124-0047
methyl 4-oxo-3-phenyl-2-[4-(pyridin-2-yl)piperazin-1-yl]-3,4-dihydroquinazoline-7-carboxylate
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
M124-0047
Molecular Formula
C25H23N5O3 (C25 H23 N5 O3)
Compound Name
methyl 4-oxo-3-phenyl-2-[4-(pyridin-2-yl)piperazin-1-yl]-3,4-dihydroquinazoline-7-carboxylate
IUPAC name
methyl 4-oxo-3-phenyl-2-[4-(pyridin-2-yl)piperazin-1-yl]-34-dihydroquinazoline-7-carboxylate
SMILES
COC(c(cc1)cc(N=C(N(CC2)CCN2c2ncccc2)N2c3ccccc3)c1C2=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
441.49
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
8
Partition Coefficient, logP
3.453
Distribution Coefficient, logD
3.444
Water Solubility, LogSw
-3.71
Polar Surface Area
61.157
Acid Dissociation Constant (pKa)
24.85
Base Dissociation Constant (pKb)
5.71
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
20.00
M124-0047 in Drug Discovery
Included in Screening Libraries
Anticancer Library (62698 compounds)
PI3K-Targeted Library (17255 compounds)
Serine Proteases Inhibitors Library (32732 compounds)
SmartTM Library (51161 compounds)
Epigenetics Focused Set (26518 compounds)
Included in 1.7M Stock Database
- Cancer
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Male
- Female
- Hemic and lymphatic
- Skin
- Infections
- Cancer
- Musculoskeletal
- Digestive system
- Respiratory tract
- Male
- Female
- Cardiovascular
- Skin
- Metabolic
- Immune system
- Kinases
- Proteases
References: we are preparing a list of scientific research reports with M124-0047 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)