1-alpha-H,5-alpha-H-Tropan-3-alpha-ol, 2,6-dimethylcarbanilate (ester)
TL;DR: 1-alpha-H,5-alpha-H-Tropan-3-alpha-ol, 2,6-dimethylcarbanilate (ester) (CAS 29364-20-3) is a chemical compound with molecular formula C17H24N2O2 and molecular weight 288.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1R,5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] N-(2,6-dimethylphenyl)carbamate
Also Known As: 5-21-01-00232 (Beilstein Handbook Reference), 1-alpha-H,5-alpha-H-Tropan-3-alpha-ol, 2,6-dimethylcarbanilate (ester), 1-alpha-H,5-alpha-H-Tropan-3-beta-ol, 2,6-dimethylcarbanilate (ester), BRN 1544964
| Molecular Formula | C17H24N2O2 |
|---|---|
| Molecular Weight | 288.18 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 41.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 288.18378 |
| Heavy Atoms | 21 |
| Complexity | 363.0 |
Chemical Identifiers
| CAS Number | 29364-20-3 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)C)NC(=O)OC2C[C@H]3CC[C@@H](C2)N3C |
| InChIKey | QEBGODUOIZYKNL-YIONKMFJSA-N |
Product Overview
1-alpha-H,5-alpha-H-Tropan-3-alpha-ol, 2,6-dimethylcarbanilate (ester) (CAS 29364-20-3), with molecular formula C17H24N2O2 and molecular weight 288.18 g/mol. IUPAC: [(1R,5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] N-(2,6-dimethylphenyl)carbamate.
Chemical Property Profile of 1-alpha-H,5-alpha-H-Tropan-3-alpha-ol, 2,6-dimethylcarbanilate (ester)
Property Insights of 1-alpha-H,5-alpha-H-Tropan-3-alpha-ol, 2,6-dimethylcarbanilate (ester)
The XLogP value of 3.4 indicates that 1-alpha-H,5-alpha-H-Tropan-3-alpha-ol, 2,6-dimethylcarbanilate (ester) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.6 Ų, 1-alpha-H,5-alpha-H-Tropan-3-alpha-ol, 2,6-dimethylcarbanilate (ester) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-alpha-H,5-alpha-H-Tropan-3-alpha-ol, 2,6-dimethylcarbanilate (ester) has 1 hydrogen bond donor(s) and 3 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 1-alpha-H,5-alpha-H-Tropan-3-alpha-ol, 2,6-dimethylcarbanilate (ester)?
The CAS number of 1-alpha-H,5-alpha-H-Tropan-3-alpha-ol, 2,6-dimethylcarbanilate (ester) is 29364-20-3.
What is the molecular formula of 1-alpha-H,5-alpha-H-Tropan-3-alpha-ol, 2,6-dimethylcarbanilate (ester)?
The molecular formula of 1-alpha-H,5-alpha-H-Tropan-3-alpha-ol, 2,6-dimethylcarbanilate (ester) is C17H24N2O2.
What is the molecular weight of 1-alpha-H,5-alpha-H-Tropan-3-alpha-ol, 2,6-dimethylcarbanilate (ester)?
The molecular weight of 1-alpha-H,5-alpha-H-Tropan-3-alpha-ol, 2,6-dimethylcarbanilate (ester) is 288.18 g/mol.
Where can I buy 1-alpha-H,5-alpha-H-Tropan-3-alpha-ol, 2,6-dimethylcarbanilate (ester)?
You can request a quote for 1-alpha-H,5-alpha-H-Tropan-3-alpha-ol, 2,6-dimethylcarbanilate (ester) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-alpha-H,5-alpha-H-Tropan-3-alpha-ol, 2,6-dimethylcarbanilate (ester)?
Yes, KEHONG BIO provides custom synthesis services for 1-alpha-H,5-alpha-H-Tropan-3-alpha-ol, 2,6-dimethylcarbanilate (ester) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.