BAS 05621354
TL;DR: BAS 05621354 (CAS 435289-94-4) is a chemical compound with molecular formula C23H22N2O5S and molecular weight 438.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-(furan-2-ylmethylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide
Also Known As: BAS 05621354, N-{3-[(furan-2-ylmethyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}-2,3-dihydro-1,4-benzodioxine-2-carboxamide, N-[3-(furan-2-ylmethylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide, Cambridge id 7018457
| Molecular Formula | C23H22N2O5S |
|---|---|
| Molecular Weight | 438.12 g/mol |
| LogP | 3.9284 |
| Topological Polar Surface Area | 89.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 438.12494 |
| Heavy Atoms | 31 |
| Complexity | 1105.3772 |
Chemical Identifiers
| CAS Number | 435289-94-4 |
|---|---|
| SMILES | C1CCC2=C(C1)C(=C(S2)NC(=O)C3COC4=CC=CC=C4O3)C(=O)NCC5=CC=CO5 |
Product Overview
BAS 05621354 (CAS 435289-94-4), with molecular formula C23H22N2O5S and molecular weight 438.12 g/mol. IUPAC: N-[3-(furan-2-ylmethylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide.
Chemical Property Profile of BAS 05621354
Property Insights of BAS 05621354
The XLogP value of 3.9284 indicates that BAS 05621354 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.8 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 05621354. Following Lipinski's Rule of Five, BAS 05621354 has 2 hydrogen bond donor(s) and 6 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 05621354?
The CAS number of BAS 05621354 is 435289-94-4.
What is the molecular formula of BAS 05621354?
The molecular formula of BAS 05621354 is C23H22N2O5S.
What is the molecular weight of BAS 05621354?
The molecular weight of BAS 05621354 is 438.12 g/mol.
Where can I buy BAS 05621354?
You can request a quote for BAS 05621354 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 05621354?
Yes, KEHONG BIO provides custom synthesis services for BAS 05621354 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.