BAS 00483396
TL;DR: BAS 00483396 (CAS 329221-36-5) is a chemical compound with molecular formula C19H20ClNO4S and molecular weight 393.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[2-(4-chloro-2-methylphenoxy)acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: BAS 00483396, methyl 2-{[(4-chloro-2-methylphenoxy)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, methyl 2-[[2-(4-chloro-2-methylphenoxy)acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, METHYL 2-[2-(4-CHLORO-2-METHYLPHENOXY)ACETAMIDO]-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBOXYLATE, methyl 2-[2-(4-chloro-2-methylphenoxy)acetylamino]-4,5,6,7-tetrahydrobenzo[b]t hiophene-3-carboxylate
| Molecular Formula | C19H20ClNO4S |
|---|---|
| Molecular Weight | 393.08 g/mol |
| LogP | 4.39282 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 393.08017 |
| Heavy Atoms | 26 |
| Complexity | 846.30493 |
Chemical Identifiers
| CAS Number | 329221-36-5 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)Cl)OCC(=O)NC2=C(C3=C(S2)CCCC3)C(=O)OC |
Product Overview
BAS 00483396 (CAS 329221-36-5), with molecular formula C19H20ClNO4S and molecular weight 393.08 g/mol. IUPAC: methyl 2-[[2-(4-chloro-2-methylphenoxy)acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.
Chemical Property Profile of BAS 00483396
Property Insights of BAS 00483396
The XLogP value of 4.39282 indicates that BAS 00483396 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00483396. Following Lipinski's Rule of Five, BAS 00483396 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00483396?
The CAS number of BAS 00483396 is 329221-36-5.
What is the molecular formula of BAS 00483396?
The molecular formula of BAS 00483396 is C19H20ClNO4S.
What is the molecular weight of BAS 00483396?
The molecular weight of BAS 00483396 is 393.08 g/mol.
Where can I buy BAS 00483396?
You can request a quote for BAS 00483396 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00483396?
Yes, KEHONG BIO provides custom synthesis services for BAS 00483396 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.