1426-2862 Screening compound: ethyl 2-[2-(4-methoxyphenoxy)acetamido]-4,5-dimethylthiophene-3-carboxylate
Chemical Structure Depiction of ChemDiv screening compound 1426-2862
ethyl 2-[2-(4-methoxyphenoxy)acetamido]-4,5-dimethylthiophene-3-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
1426-2862
Molecular Formula
C18H21NO5S (C18 H21 NO5 S)
Compound Name
ethyl 2-[2-(4-methoxyphenoxy)acetamido]-4,5-dimethylthiophene-3-carboxylate
IUPAC name
ethyl 2-[2-(4-methoxyphenoxy)acetamido]-45-dimethylthiophene-3-carboxylate
SMILES
CCOC(c1c(NC(COc(cc2)ccc2OC)=O)sc(C)c1C)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
363.43
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
9.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
3.672
Distribution Coefficient, logD
1.449
Water Solubility, LogSw
-4.05
Polar Surface Area
58.707
Acid Dissociation Constant (pKa)
5.18
Base Dissociation Constant (pKb)
-4.03
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
33.30
1426-2862 in Drug Discovery
Included in Screening Libraries
Frequent Hitters Library (7624 compounds)
Included in 1.7M Stock Database
- Pool
References: we are preparing a list of scientific research reports with 1426-2862 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)