M124-0634 Screening compound: methyl 3-(2H-1,3-benzodioxol-5-yl)-2-(diethylamino)-4-oxo-3,4-dihydroquinazoline-7-carboxylate
Chemical Structure Depiction of ChemDiv screening compound M124-0634
methyl 3-(2H-1,3-benzodioxol-5-yl)-2-(diethylamino)-4-oxo-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
M124-0634
Molecular Formula
C21H21N3O5 (C21 H21 N3 O5)
Compound Name
methyl 3-(2H-1,3-benzodioxol-5-yl)-2-(diethylamino)-4-oxo-3,4-dihydroquinazoline-7-carboxylate
IUPAC name
methyl 3-(2H-13-benzodioxol-5-yl)-2-(diethylamino)-4-oxo-34-dihydroquinazoline-7-carboxylate
SMILES
CCN(CC)C(N1c(cc2)cc3c2OCO3)=Nc(cc(cc2)C(OC)=O)c2C1=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
395.41
Hydrogen Bond Acceptors Count
8.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
8
Partition Coefficient, logP
3.026
Distribution Coefficient, logD
3.026
Water Solubility, LogSw
-3.37
Polar Surface Area
65.784
Acid Dissociation Constant (pKa)
30.32
Base Dissociation Constant (pKb)
4.36
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
28.60
M124-0634 in Drug Discovery
Included in Screening Libraries
Anti-Inflammatory Library (24602 compounds)
Protein Kinases Inhibitors Library (36801 compounds)
Serine Proteases Inhibitors Library (32732 compounds)
SmartTM Library (51161 compounds)
Targeted Diversity Library (40567 compounds)
Included in 1.7M Stock Database
- Immune system
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Nervous system
- Hemic and lymphatic
- Cardiovascular
- 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 M124-0634 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)