Propanol, 3-((2-chloro-3-benzo(b)thienyl)amino)-, S,S-dioxide
TL;DR: Propanol, 3-((2-chloro-3-benzo(b)thienyl)amino)-, S,S-dioxide (CAS 62268-30-8) is a chemical compound with molecular formula C11H12ClNO3S and molecular weight 273.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(2-chloro-1,1-dioxo-1-benzothiophen-3-yl)amino]propan-1-ol
Also Known As: Propanol, 3-((2-chloro-3-benzo(b)thienyl)amino)-, S,S-dioxide, 3-((2-Chloro-3-benzothienyl)amino)propanol S,S-dioxide, 3-[(2-chloro-1,1-dioxo-1-benzothiophen-3-yl)amino]propan-1-ol, 2-Chloro-3-[(3-hydroxypropyl)amino]-1H-1lambda~6~-benzothiophene-1,1-dione, BRN 1382995
| Molecular Formula | C11H12ClNO3S |
|---|---|
| Molecular Weight | 273.02 g/mol |
| LogP | 1.3108 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 273.02264 |
| Heavy Atoms | 17 |
| Complexity | 565.8342 |
Chemical Identifiers
| CAS Number | 62268-30-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=C(S2(=O)=O)Cl)NCCCO |
Product Overview
Propanol, 3-((2-chloro-3-benzo(b)thienyl)amino)-, S,S-dioxide (CAS 62268-30-8), with molecular formula C11H12ClNO3S and molecular weight 273.02 g/mol. IUPAC: 3-[(2-chloro-1,1-dioxo-1-benzothiophen-3-yl)amino]propan-1-ol.
Chemical Property Profile of Propanol, 3-((2-chloro-3-benzo(b)thienyl)amino)-, S,S-dioxide
Property Insights of Propanol, 3-((2-chloro-3-benzo(b)thienyl)amino)-, S,S-dioxide
The XLogP value of 1.3108 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propanol, 3-((2-chloro-3-benzo(b)thienyl)amino)-, S,S-dioxide. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Propanol, 3-((2-chloro-3-benzo(b)thienyl)amino)-, S,S-dioxide. Following Lipinski's Rule of Five, Propanol, 3-((2-chloro-3-benzo(b)thienyl)amino)-, S,S-dioxide has 2 hydrogen bond donor(s) and 4 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 Propanol, 3-((2-chloro-3-benzo(b)thienyl)amino)-, S,S-dioxide?
The CAS number of Propanol, 3-((2-chloro-3-benzo(b)thienyl)amino)-, S,S-dioxide is 62268-30-8.
What is the molecular formula of Propanol, 3-((2-chloro-3-benzo(b)thienyl)amino)-, S,S-dioxide?
The molecular formula of Propanol, 3-((2-chloro-3-benzo(b)thienyl)amino)-, S,S-dioxide is C11H12ClNO3S.
What is the molecular weight of Propanol, 3-((2-chloro-3-benzo(b)thienyl)amino)-, S,S-dioxide?
The molecular weight of Propanol, 3-((2-chloro-3-benzo(b)thienyl)amino)-, S,S-dioxide is 273.02 g/mol.
Where can I buy Propanol, 3-((2-chloro-3-benzo(b)thienyl)amino)-, S,S-dioxide?
You can request a quote for Propanol, 3-((2-chloro-3-benzo(b)thienyl)amino)-, S,S-dioxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propanol, 3-((2-chloro-3-benzo(b)thienyl)amino)-, S,S-dioxide?
Yes, KEHONG BIO provides custom synthesis services for Propanol, 3-((2-chloro-3-benzo(b)thienyl)amino)-, S,S-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.