M340-0053 Screening compound: methyl 2-({3-[(5-phenyl-1,3,4-oxadiazol-2-yl)methoxy]phenyl}sulfamoyl)benzoate
Chemical Structure Depiction of ChemDiv screening compound M340-0053
methyl 2-({3-[(5-phenyl-1,3,4-oxadiazol-2-yl)methoxy]phenyl}sulfamoyl)benzoate
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
M340-0053
Molecular Formula
C23H19N3O6S (C23 H19 N3 O6 S)
Compound Name
methyl 2-({3-[(5-phenyl-1,3,4-oxadiazol-2-yl)methoxy]phenyl}sulfamoyl)benzoate
IUPAC name
methyl 2-({3-[(5-phenyl-134-oxadiazol-2-yl)methoxy]phenyl}sulfamoyl)benzoate
SMILES
COC(c(cccc1)c1S(Nc1cc(OCc2nnc(-c3ccccc3)o2)ccc1)(=O)=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
465.49
Hydrogen Bond Acceptors Count
11.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
9.00
Number of Nitrogen and Oxygen Atoms
9
Partition Coefficient, logP
3.561
Distribution Coefficient, logD
3.503
Water Solubility, LogSw
-3.85
Polar Surface Area
99.471
Acid Dissociation Constant (pKa)
8.24
Base Dissociation Constant (pKb)
-5.54
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
8.70
M340-0053 in Drug Discovery
Included in Screening Libraries
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
Protein Kinases Inhibitors Library (36801 compounds)
Serine Proteases Inhibitors Library (32732 compounds)
Included in 1.7M Stock Database
- 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 M340-0053 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)