BAS 00483361
TL;DR: BAS 00483361 (CAS 314055-09-9) is a chemical compound with molecular formula C18H16ClNO3S2 and molecular weight 393.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-4-ethyl-5-methylthiophene-3-carboxylate
Also Known As: BAS 00483361, methyl 2-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-4-ethyl-5-methylthiophene-3-carboxylate, methyl 2-{[(3-chloro-1-benzothien-2-yl)carbonyl]amino}-4-ethyl-5-methyl-3-thiophenecarboxylate, methyl 2-[(3-chlorobenzo[b]thiophen-2-yl)carbonylamino]-4-ethyl-5-methylthioph ene-3-carboxylate, METHYL 2-{[(3-CHLORO-1-BENZOTHIOPHEN-2-YL)CARBONYL]AMINO}-4-ETHYL-5-METHYL-3-THIOPHENECARBOXYLATE
| Molecular Formula | C18H16ClNO3S2 |
|---|---|
| Molecular Weight | 393.03 g/mol |
| LogP | 5.52592 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 393.026 |
| Heavy Atoms | 25 |
| Complexity | 974.26544 |
Chemical Identifiers
| CAS Number | 314055-09-9 |
|---|---|
| SMILES | CCC1=C(SC(=C1C(=O)OC)NC(=O)C2=C(C3=CC=CC=C3S2)Cl)C |
Product Overview
BAS 00483361 (CAS 314055-09-9), with molecular formula C18H16ClNO3S2 and molecular weight 393.03 g/mol. IUPAC: methyl 2-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-4-ethyl-5-methylthiophene-3-carboxylate.
Chemical Property Profile of BAS 00483361
Property Insights of BAS 00483361
The XLogP value of 5.52592 indicates that BAS 00483361 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, BAS 00483361 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00483361 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00483361?
The CAS number of BAS 00483361 is 314055-09-9.
What is the molecular formula of BAS 00483361?
The molecular formula of BAS 00483361 is C18H16ClNO3S2.
What is the molecular weight of BAS 00483361?
The molecular weight of BAS 00483361 is 393.03 g/mol.
Where can I buy BAS 00483361?
You can request a quote for BAS 00483361 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00483361?
Yes, KEHONG BIO provides custom synthesis services for BAS 00483361 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.