M875-3112 Screening compound: ethyl 2-[N-(3,5-dimethylphenyl)3-methyl-[1,2,4]triazolo[4,3-a]pyridine-8-sulfonamido]acetate
Chemical Structure Depiction of ChemDiv screening compound M875-3112
ethyl 2-[N-(3,5-dimethylphenyl)3-methyl-[1,2,4]triazolo[4,3-a]pyridine-8-sulfonamido]acetate
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
M875-3112
Molecular Formula
C19H22N4O4S (C19 H22 N4 O4 S)
Compound Name
ethyl 2-[N-(3,5-dimethylphenyl)3-methyl-[1,2,4]triazolo[4,3-a]pyridine-8-sulfonamido]acetate
IUPAC name
ethyl 2-[N-(35-dimethylphenyl)3-methyl-[124]triazolo[43-a]pyridine-8-sulfonamido]acetate
SMILES
CCOC(CN(c1cc(C)cc(C)c1)S(c1cccn2c1nnc2C)(=O)=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
402.47
Hydrogen Bond Acceptors Count
9.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
7.00
Number of Nitrogen and Oxygen Atoms
8
Partition Coefficient, logP
2.041
Distribution Coefficient, logD
2.041
Water Solubility, LogSw
-2.61
Polar Surface Area
75.156
Acid Dissociation Constant (pKa)
20.50
Base Dissociation Constant (pKb)
1.59
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
31.60
M875-3112 in Drug Discovery
Included in Screening Libraries
Antifungal Library (16415 compounds)
Included in 1.7M Stock Database
- Infections
- Immune system
- animal
- Agro
References: we are preparing a list of scientific research reports with M875-3112 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)