4-(Benzyloxy)phenyl 2-oxo-1,2-dihydrobenzo[cd]indole-6-sulfonate
TL;DR: 4-(Benzyloxy)phenyl 2-oxo-1,2-dihydrobenzo[cd]indole-6-sulfonate (CAS 425374-63-6) is a chemical compound with molecular formula C24H17NO5S and molecular weight 431.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-phenylmethoxyphenyl) 2-oxo-1H-benzo[cd]indole-6-sulfonate
Also Known As: ChemDiv1_023036, 4-(benzyloxy)phenyl 2-oxo-1,2-dihydrobenzo[cd]indole-6-sulfonate, AJ-292/40927167, (4-phenylmethoxyphenyl) 2-oxo-1H-benzo[cd]indole-6-sulfonate
| Molecular Formula | C24H17NO5S |
|---|---|
| Molecular Weight | 431.08 g/mol |
| LogP | 4.7522 |
| Topological Polar Surface Area | 81.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 431.08273 |
| Heavy Atoms | 31 |
| Complexity | 1397.6215 |
Chemical Identifiers
| CAS Number | 425374-63-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC2=CC=C(C=C2)OS(=O)(=O)C3=C4C=CC=C5C4=C(C=C3)NC5=O |
Product Overview
4-(Benzyloxy)phenyl 2-oxo-1,2-dihydrobenzo[cd]indole-6-sulfonate (CAS 425374-63-6), with molecular formula C24H17NO5S and molecular weight 431.08 g/mol. IUPAC: (4-phenylmethoxyphenyl) 2-oxo-1H-benzo[cd]indole-6-sulfonate.
Chemical Property Profile of 4-(Benzyloxy)phenyl 2-oxo-1,2-dihydrobenzo[cd]indole-6-sulfonate
Property Insights of 4-(Benzyloxy)phenyl 2-oxo-1,2-dihydrobenzo[cd]indole-6-sulfonate
The XLogP value of 4.7522 indicates that 4-(Benzyloxy)phenyl 2-oxo-1,2-dihydrobenzo[cd]indole-6-sulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(Benzyloxy)phenyl 2-oxo-1,2-dihydrobenzo[cd]indole-6-sulfonate. Following Lipinski's Rule of Five, 4-(Benzyloxy)phenyl 2-oxo-1,2-dihydrobenzo[cd]indole-6-sulfonate 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 4-(Benzyloxy)phenyl 2-oxo-1,2-dihydrobenzo[cd]indole-6-sulfonate?
The CAS number of 4-(Benzyloxy)phenyl 2-oxo-1,2-dihydrobenzo[cd]indole-6-sulfonate is 425374-63-6.
What is the molecular formula of 4-(Benzyloxy)phenyl 2-oxo-1,2-dihydrobenzo[cd]indole-6-sulfonate?
The molecular formula of 4-(Benzyloxy)phenyl 2-oxo-1,2-dihydrobenzo[cd]indole-6-sulfonate is C24H17NO5S.
What is the molecular weight of 4-(Benzyloxy)phenyl 2-oxo-1,2-dihydrobenzo[cd]indole-6-sulfonate?
The molecular weight of 4-(Benzyloxy)phenyl 2-oxo-1,2-dihydrobenzo[cd]indole-6-sulfonate is 431.08 g/mol.
Where can I buy 4-(Benzyloxy)phenyl 2-oxo-1,2-dihydrobenzo[cd]indole-6-sulfonate?
You can request a quote for 4-(Benzyloxy)phenyl 2-oxo-1,2-dihydrobenzo[cd]indole-6-sulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Benzyloxy)phenyl 2-oxo-1,2-dihydrobenzo[cd]indole-6-sulfonate?
Yes, KEHONG BIO provides custom synthesis services for 4-(Benzyloxy)phenyl 2-oxo-1,2-dihydrobenzo[cd]indole-6-sulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.