2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecane, phenylaminomethyl-
TL;DR: 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecane, phenylaminomethyl- (CAS 3771-70-8) is a chemical compound with molecular formula C13H20N2O3Si and molecular weight 280.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,8,9-trioxa-5-aza-1-silabicyclo[3.3.3]undecan-1-ylmethyl)aniline
Also Known As: Fenylaminomethylsilatran, Phenylaminomethylsilatrane, Silatrane, phenylaminomethyl-, Fenylaminomethylsilatran [Czech], 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecane, phenylaminomethyl-
| Molecular Formula | C13H20N2O3Si |
|---|---|
| Molecular Weight | 280.12 g/mol |
| LogP | 0.9556 |
| Topological Polar Surface Area | 43.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 280.12433 |
| Heavy Atoms | 19 |
| Complexity | 261.0 |
Chemical Identifiers
| CAS Number | 3771-70-8 |
|---|---|
| SMILES | C1CO[Si]2(OCCN1CCO2)CNC3=CC=CC=C3 |
| InChIKey | YGHSPISFNKUQEY-UHFFFAOYSA-N |
Product Overview
2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecane, phenylaminomethyl- (CAS 3771-70-8), with molecular formula C13H20N2O3Si and molecular weight 280.12 g/mol. IUPAC: N-(2,8,9-trioxa-5-aza-1-silabicyclo[3.3.3]undecan-1-ylmethyl)aniline.
Chemical Property Profile of 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecane, phenylaminomethyl-
Property Insights of 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecane, phenylaminomethyl-
The XLogP value of 0.9556 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecane, phenylaminomethyl-. With a topological polar surface area (TPSA) of 43.0 Ų, 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecane, phenylaminomethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecane, phenylaminomethyl- 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 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecane, phenylaminomethyl-?
The CAS number of 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecane, phenylaminomethyl- is 3771-70-8.
What is the molecular formula of 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecane, phenylaminomethyl-?
The molecular formula of 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecane, phenylaminomethyl- is C13H20N2O3Si.
What is the molecular weight of 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecane, phenylaminomethyl-?
The molecular weight of 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecane, phenylaminomethyl- is 280.12 g/mol.
Where can I buy 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecane, phenylaminomethyl-?
You can request a quote for 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecane, phenylaminomethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecane, phenylaminomethyl-?
Yes, KEHONG BIO provides custom synthesis services for 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecane, phenylaminomethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.