Y503-0252 Screening compound: methyl 2-{[2-(2,4-dichlorophenoxy)acetyl]amino}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of ChemDiv screening compound Y503-0252
methyl 2-{[2-(2,4-dichlorophenoxy)acetyl]amino}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-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
Y503-0252
Molecular Formula
C19H19Cl2NO4S (C19 H19 Cl2 NO4 S)
Compound Name
methyl 2-{[2-(2,4-dichlorophenoxy)acetyl]amino}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
IUPAC name
methyl 2-[2-(24-dichlorophenoxy)acetamido]-6-methyl-4567-tetrahydro-1-benzothiophene-3-carboxylate
SMILES
CC(CC1)Cc2c1c(C(OC)=O)c(NC(COc(ccc(Cl)c1)c1Cl)=O)s2
InChI Key
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
428.34
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
7.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
5.206
Distribution Coefficient, logD
3.024
Water Solubility, LogSw
-5.99
Polar Surface Area
51.591
Acid Dissociation Constant (pKa)
5.22
Base Dissociation Constant (pKb)
-4.51
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
36.84
References: we are preparing a list of scientific research reports with Y503-0252 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)