9-Hydroxy Propantheline Bromide
TL;DR: 9-Hydroxy Propantheline Bromide (CAS 93446-02-7) is a chemical compound with molecular formula C23H30BrNO4 and molecular weight 463.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(9-hydroxyxanthene-9-carbonyl)oxyethyl-methyl-di(propan-2-yl)azanium bromide
Also Known As: 9-Hydroxy Propantheline Bromide, 9-Hydroxypropantheline Bromide, 2-(9-hydroxyxanthene-9-carbonyl)oxyethyl-methyl-di(propan-2-yl)azanium;bromide, 2-(9-hydroxyxanthene-9-carbonyl)oxyethyl-methyl-dipropan-2-yl-azanium Bromide, 2-(9-hydroxyxanthene-9-carbonyl)oxyethyl-methyl-di(propan-2-yl)azanium bromide
| Molecular Formula | C23H30BrNO4 |
|---|---|
| Molecular Weight | 463.14 g/mol |
| LogP | 0.8388 |
| Topological Polar Surface Area | 55.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 463.13583 |
| Heavy Atoms | 29 |
| Complexity | 517.0 |
Chemical Identifiers
| CAS Number | 93446-02-7 |
|---|---|
| SMILES | CC(C)[N+](C)(CCOC(=O)C1(C2=CC=CC=C2OC3=CC=CC=C31)O)C(C)C.[Br-] |
| InChIKey | RDMADSXCPWAZRH-UHFFFAOYSA-M |
Product Overview
9-Hydroxy Propantheline Bromide (CAS 93446-02-7), with molecular formula C23H30BrNO4 and molecular weight 463.14 g/mol. IUPAC: 2-(9-hydroxyxanthene-9-carbonyl)oxyethyl-methyl-di(propan-2-yl)azanium bromide.
Chemical Property Profile of 9-Hydroxy Propantheline Bromide
Property Insights of 9-Hydroxy Propantheline Bromide
The XLogP value of 0.8388 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 9-Hydroxy Propantheline Bromide. With a topological polar surface area (TPSA) of 55.8 Ų, 9-Hydroxy Propantheline Bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9-Hydroxy Propantheline Bromide 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 9-Hydroxy Propantheline Bromide?
The CAS number of 9-Hydroxy Propantheline Bromide is 93446-02-7.
What is the molecular formula of 9-Hydroxy Propantheline Bromide?
The molecular formula of 9-Hydroxy Propantheline Bromide is C23H30BrNO4.
What is the molecular weight of 9-Hydroxy Propantheline Bromide?
The molecular weight of 9-Hydroxy Propantheline Bromide is 463.14 g/mol.
Where can I buy 9-Hydroxy Propantheline Bromide?
You can request a quote for 9-Hydroxy Propantheline Bromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-Hydroxy Propantheline Bromide?
Yes, KEHONG BIO provides custom synthesis services for 9-Hydroxy Propantheline Bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.