A3285/0139806
TL;DR: A3285/0139806 (CAS 1212469-63-0) is a chemical compound with molecular formula C19H22BrN3O2 and molecular weight 403.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5'-bromo-5-methyl-7-propylspiro[1,3-diazatricyclo[3.3.1.13,7]decane-2,3'-1H-indole]-2',6-dione
Also Known As: A3285/0139806, 5'-bromo-5-methyl-7-propyl-6H-spiro[1,3-diazatricyclo[3.3.1.1~3,7~]decane-2,3'-indole]-2',6(1'H)-dione, (1S,5R,7S)-5'-bromo-5-methyl-7-propyl-1,3-diazaspiro[adamantane-2,3'-indoline]-2',6-dione
| Molecular Formula | C19H22BrN3O2 |
|---|---|
| Molecular Weight | 403.09 g/mol |
| LogP | 2.5607 |
| Topological Polar Surface Area | 52.65 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 403.08954 |
| Heavy Atoms | 25 |
| Complexity | 804.88727 |
Chemical Identifiers
| CAS Number | 1212469-63-0 |
|---|---|
| SMILES | CCCC12CN3CC(C1=O)(CN(C2)C34C5=C(C=CC(=C5)Br)NC4=O)C |
Product Overview
A3285/0139806 (CAS 1212469-63-0), with molecular formula C19H22BrN3O2 and molecular weight 403.09 g/mol. IUPAC: 5'-bromo-5-methyl-7-propylspiro[1,3-diazatricyclo[3.3.1.13,7]decane-2,3'-1H-indole]-2',6-dione.
Chemical Property Profile of A3285/0139806
Property Insights of A3285/0139806
The XLogP value of 2.5607 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A3285/0139806. With a topological polar surface area (TPSA) of 52.65 Ų, A3285/0139806 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, A3285/0139806 has 1 hydrogen bond donor(s) and 4 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 A3285/0139806?
The CAS number of A3285/0139806 is 1212469-63-0.
What is the molecular formula of A3285/0139806?
The molecular formula of A3285/0139806 is C19H22BrN3O2.
What is the molecular weight of A3285/0139806?
The molecular weight of A3285/0139806 is 403.09 g/mol.
Where can I buy A3285/0139806?
You can request a quote for A3285/0139806 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3285/0139806?
Yes, KEHONG BIO provides custom synthesis services for A3285/0139806 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.