1-Sec-butyl-8-methyl-3,6-diazatricyclo[4.3.1.1~3,8~]undecan-9-one
TL;DR: 1-Sec-butyl-8-methyl-3,6-diazatricyclo[4.3.1.1~3,8~]undecan-9-one (CAS 351332-36-0) is a chemical compound with molecular formula C14H24N2O and molecular weight 236.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-butan-2-yl-8-methyl-3,6-diazatricyclo[4.3.1.13,8]undecan-9-one
Also Known As: 1-sec-butyl-8-methyl-3,6-diazatricyclo[4.3.1.1~3,8~]undecan-9-one, AN-604/13256010, 1-Methyl-8-(1-methylpropyl)-3,6-diazatricyclo[4.3.1.13,8]undecan-9-one, 1-(Butan-2-yl)-8-methyl-3,6-diazatricyclo[4.3.1.1~3,8~]undecan-9-one, 1-butan-2-yl-8-methyl-3,6-diazatricyclo[4.3.1.13,8]undecan-9-one
| Molecular Formula | C14H24N2O |
|---|---|
| Molecular Weight | 236.19 g/mol |
| LogP | 1.2391 |
| Topological Polar Surface Area | 23.55 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 236.18886 |
| Heavy Atoms | 17 |
| Complexity | 336.13138 |
Chemical Identifiers
| CAS Number | 351332-36-0 |
|---|---|
| SMILES | CCC(C)C12CN3CCN(C1)CC(C3)(C2=O)C |
Product Overview
1-Sec-butyl-8-methyl-3,6-diazatricyclo[4.3.1.1~3,8~]undecan-9-one (CAS 351332-36-0), with molecular formula C14H24N2O and molecular weight 236.19 g/mol. IUPAC: 1-butan-2-yl-8-methyl-3,6-diazatricyclo[4.3.1.13,8]undecan-9-one.
Chemical Property Profile of 1-Sec-butyl-8-methyl-3,6-diazatricyclo[4.3.1.1~3,8~]undecan-9-one
Property Insights of 1-Sec-butyl-8-methyl-3,6-diazatricyclo[4.3.1.1~3,8~]undecan-9-one
The XLogP value of 1.2391 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Sec-butyl-8-methyl-3,6-diazatricyclo[4.3.1.1~3,8~]undecan-9-one. With a topological polar surface area (TPSA) of 23.55 Ų, 1-Sec-butyl-8-methyl-3,6-diazatricyclo[4.3.1.1~3,8~]undecan-9-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Sec-butyl-8-methyl-3,6-diazatricyclo[4.3.1.1~3,8~]undecan-9-one has 0 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-Sec-butyl-8-methyl-3,6-diazatricyclo[4.3.1.1~3,8~]undecan-9-one?
The CAS number of 1-Sec-butyl-8-methyl-3,6-diazatricyclo[4.3.1.1~3,8~]undecan-9-one is 351332-36-0.
What is the molecular formula of 1-Sec-butyl-8-methyl-3,6-diazatricyclo[4.3.1.1~3,8~]undecan-9-one?
The molecular formula of 1-Sec-butyl-8-methyl-3,6-diazatricyclo[4.3.1.1~3,8~]undecan-9-one is C14H24N2O.
What is the molecular weight of 1-Sec-butyl-8-methyl-3,6-diazatricyclo[4.3.1.1~3,8~]undecan-9-one?
The molecular weight of 1-Sec-butyl-8-methyl-3,6-diazatricyclo[4.3.1.1~3,8~]undecan-9-one is 236.19 g/mol.
Where can I buy 1-Sec-butyl-8-methyl-3,6-diazatricyclo[4.3.1.1~3,8~]undecan-9-one?
You can request a quote for 1-Sec-butyl-8-methyl-3,6-diazatricyclo[4.3.1.1~3,8~]undecan-9-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Sec-butyl-8-methyl-3,6-diazatricyclo[4.3.1.1~3,8~]undecan-9-one?
Yes, KEHONG BIO provides custom synthesis services for 1-Sec-butyl-8-methyl-3,6-diazatricyclo[4.3.1.1~3,8~]undecan-9-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.