3,7-Diazabicyclo(3.3.1)nonane-3-carboxamide, N-butyl-9-oxo-2,4,6,8-tetraphenyl-
TL;DR: 3,7-Diazabicyclo(3.3.1)nonane-3-carboxamide, N-butyl-9-oxo-2,4,6,8-tetraphenyl- (CAS 82058-26-2) is a chemical compound with molecular formula C36H37N3O2 and molecular weight 543.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-butyl-9-oxo-2,4,6,8-tetraphenyl-3,7-diazabicyclo[3.3.1]nonane-3-carboxamide
Also Known As: ITA 429, N-Butyl-9-oxo-2,4,6,8-tetraphenyl-3,7-diazabicyclo(3.3.1)nonane-3-carboxamide, 3,7-DIAZABICYCLO(3.3.1)NONANE-3-CARBOXAMIDE, N-BUTYL-9-OXO-2,4,6,8-TETRAPHENYL-, N-butyl-9-oxo-2,4,6,8-tetra(phenyl)-3,7-diazabicyclo[3.3.1]nonane-7-carboxamide, N-butyl-9-oxo-2,4,6,8-tetraphenyl-3,7-diazabicyclo[3.3.1]nonane-3-carboxamide
| Molecular Formula | C36H37N3O2 |
|---|---|
| Molecular Weight | 543.29 g/mol |
| LogP | 5.8 |
| Topological Polar Surface Area | 61.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 543.2886 |
| Heavy Atoms | 41 |
| Complexity | 797.0 |
Chemical Identifiers
| CAS Number | 82058-26-2 |
|---|---|
| SMILES | CCCCNC(=O)N1C(C2C(NC(C(C1C3=CC=CC=C3)C2=O)C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6 |
| InChIKey | KCJLMPALOLQKKS-UHFFFAOYSA-N |
Product Overview
3,7-Diazabicyclo(3.3.1)nonane-3-carboxamide, N-butyl-9-oxo-2,4,6,8-tetraphenyl- (CAS 82058-26-2), with molecular formula C36H37N3O2 and molecular weight 543.29 g/mol. IUPAC: N-butyl-9-oxo-2,4,6,8-tetraphenyl-3,7-diazabicyclo[3.3.1]nonane-3-carboxamide.
Chemical Property Profile of 3,7-Diazabicyclo(3.3.1)nonane-3-carboxamide, N-butyl-9-oxo-2,4,6,8-tetraphenyl-
Property Insights of 3,7-Diazabicyclo(3.3.1)nonane-3-carboxamide, N-butyl-9-oxo-2,4,6,8-tetraphenyl-
The XLogP value of 5.8 indicates that 3,7-Diazabicyclo(3.3.1)nonane-3-carboxamide, N-butyl-9-oxo-2,4,6,8-tetraphenyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,7-Diazabicyclo(3.3.1)nonane-3-carboxamide, N-butyl-9-oxo-2,4,6,8-tetraphenyl-. Following Lipinski's Rule of Five, 3,7-Diazabicyclo(3.3.1)nonane-3-carboxamide, N-butyl-9-oxo-2,4,6,8-tetraphenyl- has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3,7-Diazabicyclo(3.3.1)nonane-3-carboxamide, N-butyl-9-oxo-2,4,6,8-tetraphenyl-?
The CAS number of 3,7-Diazabicyclo(3.3.1)nonane-3-carboxamide, N-butyl-9-oxo-2,4,6,8-tetraphenyl- is 82058-26-2.
What is the molecular formula of 3,7-Diazabicyclo(3.3.1)nonane-3-carboxamide, N-butyl-9-oxo-2,4,6,8-tetraphenyl-?
The molecular formula of 3,7-Diazabicyclo(3.3.1)nonane-3-carboxamide, N-butyl-9-oxo-2,4,6,8-tetraphenyl- is C36H37N3O2.
What is the molecular weight of 3,7-Diazabicyclo(3.3.1)nonane-3-carboxamide, N-butyl-9-oxo-2,4,6,8-tetraphenyl-?
The molecular weight of 3,7-Diazabicyclo(3.3.1)nonane-3-carboxamide, N-butyl-9-oxo-2,4,6,8-tetraphenyl- is 543.29 g/mol.
Where can I buy 3,7-Diazabicyclo(3.3.1)nonane-3-carboxamide, N-butyl-9-oxo-2,4,6,8-tetraphenyl-?
You can request a quote for 3,7-Diazabicyclo(3.3.1)nonane-3-carboxamide, N-butyl-9-oxo-2,4,6,8-tetraphenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,7-Diazabicyclo(3.3.1)nonane-3-carboxamide, N-butyl-9-oxo-2,4,6,8-tetraphenyl-?
Yes, KEHONG BIO provides custom synthesis services for 3,7-Diazabicyclo(3.3.1)nonane-3-carboxamide, N-butyl-9-oxo-2,4,6,8-tetraphenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.