BAS 00264547
TL;DR: BAS 00264547 (CAS 294669-13-9) is a chemical compound with molecular formula C19H21NO3S and molecular weight 343.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(2-methylbenzoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: BAS 00264547, A0141/0006210, ethyl 2-[(2-methylbenzoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, ETHYL 2-(2-METHYLBENZAMIDO)-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBOXYLATE, ethyl 2-(2-methylbenzamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate
| Molecular Formula | C19H21NO3S |
|---|---|
| Molecular Weight | 343.12 g/mol |
| LogP | 5.1 |
| Topological Polar Surface Area | 83.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 343.1242 |
| Heavy Atoms | 24 |
| Complexity | 470.0 |
Chemical Identifiers
| CAS Number | 294669-13-9 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=CC=CC=C3C |
| InChIKey | UEHVHOOXJVUUQX-UHFFFAOYSA-N |
Product Overview
BAS 00264547 (CAS 294669-13-9), with molecular formula C19H21NO3S and molecular weight 343.12 g/mol. IUPAC: ethyl 2-[(2-methylbenzoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.
Chemical Property Profile of BAS 00264547
Property Insights of BAS 00264547
The XLogP value of 5.1 indicates that BAS 00264547 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.6 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00264547. Following Lipinski's Rule of Five, BAS 00264547 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00264547?
The CAS number of BAS 00264547 is 294669-13-9.
What is the molecular formula of BAS 00264547?
The molecular formula of BAS 00264547 is C19H21NO3S.
What is the molecular weight of BAS 00264547?
The molecular weight of BAS 00264547 is 343.12 g/mol.
Where can I buy BAS 00264547?
You can request a quote for BAS 00264547 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00264547?
Yes, KEHONG BIO provides custom synthesis services for BAS 00264547 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.