(6-羟基-8-甲基-8-氮杂双环[3.2.1]辛-3-基)3-羟基-2-苯基丙酸酯
TL;DR: (6-羟基-8-甲基-8-氮杂双环[3.2.1]辛-3-基)3-羟基-2-苯基丙酸酯 (CAS 17659-49-3) is a chemical compound with molecular formula C17H23NO4 and molecular weight 305.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6-羟基-8-甲基-8-氮杂双环[3.2.1]辛-3-基)3-羟基-2-苯基丙酸酯
(6-hydroxy-8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 3-hydroxy-2-phenylpropanoate
Also Known As: racanisodamine, anisodamine, Raceanisodamine, rac-Anisodamine, 6-Hydroxyhyoscyamine
| Molecular Formula | C17H23NO4 |
|---|---|
| Molecular Weight | 305.16 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 70.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 305.16272 |
| Heavy Atoms | 22 |
| Complexity | 396.0 |
Chemical Identifiers
| CAS Number | 17659-49-3 |
|---|---|
| SMILES | CN1C2CC(CC1C(C2)O)OC(=O)C(CO)C3=CC=CC=C3 |
| InChIKey | WTQYWNWRJNXDEG-UHFFFAOYSA-N |
Product Overview
(6-羟基-8-甲基-8-氮杂双环[3.2.1]辛-3-基)3-羟基-2-苯基丙酸酯 (CAS 17659-49-3), with molecular formula C17H23NO4 and molecular weight 305.16 g/mol. IUPAC: (6-hydroxy-8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 3-hydroxy-2-phenylpropanoate.
Chemical Property Profile of (6-羟基-8-甲基-8-氮杂双环[3.2.1]辛-3-基)3-羟基-2-苯基丙酸酯
Property Insights of (6-羟基-8-甲基-8-氮杂双环[3.2.1]辛-3-基)3-羟基-2-苯基丙酸酯
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (6-羟基-8-甲基-8-氮杂双环[3.2.1]辛-3-基)3-羟基-2-苯基丙酸酯. The TPSA of 70.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (6-羟基-8-甲基-8-氮杂双环[3.2.1]辛-3-基)3-羟基-2-苯基丙酸酯. Following Lipinski's Rule of Five, (6-羟基-8-甲基-8-氮杂双环[3.2.1]辛-3-基)3-羟基-2-苯基丙酸酯 has 2 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 (6-羟基-8-甲基-8-氮杂双环[3.2.1]辛-3-基)3-羟基-2-苯基丙酸酯?
The CAS number of (6-羟基-8-甲基-8-氮杂双环[3.2.1]辛-3-基)3-羟基-2-苯基丙酸酯 is 17659-49-3.
What is the molecular formula of (6-羟基-8-甲基-8-氮杂双环[3.2.1]辛-3-基)3-羟基-2-苯基丙酸酯?
The molecular formula of (6-羟基-8-甲基-8-氮杂双环[3.2.1]辛-3-基)3-羟基-2-苯基丙酸酯 is C17H23NO4.
What is the molecular weight of (6-羟基-8-甲基-8-氮杂双环[3.2.1]辛-3-基)3-羟基-2-苯基丙酸酯?
The molecular weight of (6-羟基-8-甲基-8-氮杂双环[3.2.1]辛-3-基)3-羟基-2-苯基丙酸酯 is 305.16 g/mol.
Where can I buy (6-羟基-8-甲基-8-氮杂双环[3.2.1]辛-3-基)3-羟基-2-苯基丙酸酯?
You can request a quote for (6-羟基-8-甲基-8-氮杂双环[3.2.1]辛-3-基)3-羟基-2-苯基丙酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (6-羟基-8-甲基-8-氮杂双环[3.2.1]辛-3-基)3-羟基-2-苯基丙酸酯?
Yes, KEHONG BIO provides custom synthesis services for (6-羟基-8-甲基-8-氮杂双环[3.2.1]辛-3-基)3-羟基-2-苯基丙酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.