AB00094141-01
TL;DR: AB00094141-01 (CAS 397880-46-5) is a chemical compound with molecular formula C21H27N3O2 and molecular weight 353.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,5',7-trimethyl-1'-propylspiro[1,3-diazatricyclo[3.3.1.13,7]decane-2,3'-indole]-2',6-dione
Also Known As: AB00094141-01, (1R,3S,5r,7r)-5,5',7-trimethyl-1'-propyl-1,3-diazaspiro[adamantane-2,3'-indoline]-2',6-dione, (5r,7s)-5,5',7-trimethyl-1'-propyl-6H-spiro[1,3-diazatricyclo[3.3.1.1~3,7~]decane-2,3'-indole]-2',6(1'H)-dione, 5,5',7-trimethyl-1'-propyl-6H-spiro[1,3-diazatricyclo[3.3.1.1~3,7~]decane-2,3'-indole]-2',6(1'H)-dione
| Molecular Formula | C21H27N3O2 |
|---|---|
| Molecular Weight | 353.21 g/mol |
| LogP | 2.13092 |
| Topological Polar Surface Area | 43.86 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 353.21033 |
| Heavy Atoms | 26 |
| Complexity | 805.65796 |
Chemical Identifiers
| CAS Number | 397880-46-5 |
|---|---|
| SMILES | CCCN1C2=C(C=C(C=C2)C)C3(C1=O)N4CC5(CN3CC(C4)(C5=O)C)C |
Product Overview
AB00094141-01 (CAS 397880-46-5), with molecular formula C21H27N3O2 and molecular weight 353.21 g/mol. IUPAC: 5,5',7-trimethyl-1'-propylspiro[1,3-diazatricyclo[3.3.1.13,7]decane-2,3'-indole]-2',6-dione.
Chemical Property Profile of AB00094141-01
Property Insights of AB00094141-01
The XLogP value of 2.13092 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00094141-01. With a topological polar surface area (TPSA) of 43.86 Ų, AB00094141-01 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB00094141-01 has 0 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 AB00094141-01?
The CAS number of AB00094141-01 is 397880-46-5.
What is the molecular formula of AB00094141-01?
The molecular formula of AB00094141-01 is C21H27N3O2.
What is the molecular weight of AB00094141-01?
The molecular weight of AB00094141-01 is 353.21 g/mol.
Where can I buy AB00094141-01?
You can request a quote for AB00094141-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00094141-01?
Yes, KEHONG BIO provides custom synthesis services for AB00094141-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.