2-Propanol, 1-(3-adamantylmethoxymethyl)-3-(hexahydro-1H-azepinyl)-
TL;DR: 2-Propanol, 1-(3-adamantylmethoxymethyl)-3-(hexahydro-1H-azepinyl)- (CAS 73972-47-1) is a chemical compound with molecular formula C21H37NO2 and molecular weight 335.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(1-adamantylmethoxy)-1-(azepan-1-yl)butan-2-ol
Also Known As: 1-(3-Adamantylmethoxymethyl)-3-(hexahydro-1H-azepinyl)-2-propanol, 4-(1-adamantylmethoxy)-1-(azepan-1-yl)butan-2-ol, 2-Propanol, 1-(3-adamantylmethoxymethyl)-3-(hexahydro-1H-azepinyl)-, 1H-Azepine-1-ethanol, hexahydro-alpha-(2-(tricyclo(3.3.1.13,7)dec-1-ylmethoxy)ethyl)-, 4-[(Adamantan-1-yl)methoxy]-1-(azepan-1-yl)butan-2-ol
| Molecular Formula | C21H37NO2 |
|---|---|
| Molecular Weight | 335.28 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 32.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 335.28244 |
| Heavy Atoms | 24 |
| Complexity | 361.0 |
Chemical Identifiers
| CAS Number | 73972-47-1 |
|---|---|
| SMILES | C1CCCN(CC1)CC(CCOCC23CC4CC(C2)CC(C4)C3)O |
| InChIKey | ODFUUKDOWIAKCG-UHFFFAOYSA-N |
Product Overview
2-Propanol, 1-(3-adamantylmethoxymethyl)-3-(hexahydro-1H-azepinyl)- (CAS 73972-47-1), with molecular formula C21H37NO2 and molecular weight 335.28 g/mol. IUPAC: 4-(1-adamantylmethoxy)-1-(azepan-1-yl)butan-2-ol.
Chemical Property Profile of 2-Propanol, 1-(3-adamantylmethoxymethyl)-3-(hexahydro-1H-azepinyl)-
Property Insights of 2-Propanol, 1-(3-adamantylmethoxymethyl)-3-(hexahydro-1H-azepinyl)-
The XLogP value of 4.0 indicates that 2-Propanol, 1-(3-adamantylmethoxymethyl)-3-(hexahydro-1H-azepinyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.7 Ų, 2-Propanol, 1-(3-adamantylmethoxymethyl)-3-(hexahydro-1H-azepinyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Propanol, 1-(3-adamantylmethoxymethyl)-3-(hexahydro-1H-azepinyl)- 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 2-Propanol, 1-(3-adamantylmethoxymethyl)-3-(hexahydro-1H-azepinyl)-?
The CAS number of 2-Propanol, 1-(3-adamantylmethoxymethyl)-3-(hexahydro-1H-azepinyl)- is 73972-47-1.
What is the molecular formula of 2-Propanol, 1-(3-adamantylmethoxymethyl)-3-(hexahydro-1H-azepinyl)-?
The molecular formula of 2-Propanol, 1-(3-adamantylmethoxymethyl)-3-(hexahydro-1H-azepinyl)- is C21H37NO2.
What is the molecular weight of 2-Propanol, 1-(3-adamantylmethoxymethyl)-3-(hexahydro-1H-azepinyl)-?
The molecular weight of 2-Propanol, 1-(3-adamantylmethoxymethyl)-3-(hexahydro-1H-azepinyl)- is 335.28 g/mol.
Where can I buy 2-Propanol, 1-(3-adamantylmethoxymethyl)-3-(hexahydro-1H-azepinyl)-?
You can request a quote for 2-Propanol, 1-(3-adamantylmethoxymethyl)-3-(hexahydro-1H-azepinyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Propanol, 1-(3-adamantylmethoxymethyl)-3-(hexahydro-1H-azepinyl)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Propanol, 1-(3-adamantylmethoxymethyl)-3-(hexahydro-1H-azepinyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.