E208-0170 Screening compound: propan-2-yl 4-({1-methyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl}amino)benzoate
Chemical Structure Depiction of ChemDiv screening compound E208-0170
propan-2-yl 4-({1-methyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl}amino)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
E208-0170
Molecular Formula
C20H19N5O2 (C20 H19 N5 O2)
Compound Name
propan-2-yl 4-({1-methyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl}amino)benzoate
IUPAC name
propan-2-yl 4-({1-methyl-[124]triazolo[43-a]quinoxalin-4-yl}amino)benzoate
SMILES
CC(C)OC(c(cc1)ccc1Nc1nc(cccc2)c2n2c1nnc2C)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
361.4
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
3.547
Distribution Coefficient, logD
3.538
Water Solubility, LogSw
-3.56
Polar Surface Area
60.682
Acid Dissociation Constant (pKa)
19.60
Base Dissociation Constant (pKb)
5.71
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
20.00
E208-0170 in Drug Discovery
Included in Screening Libraries
Antifungal Library (16415 compounds)
Purinergic Library (3321 compounds)
Included in 1.7M Stock Database
- Infections
- Immune system
- animal
- Nervous system
- Cardiovascular
- Metabolic
- Agro
- GPCR
- Ion Channels
- Receptor's ligands
References: we are preparing a list of scientific research reports with E208-0170 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)