AB00345214-03
TL;DR: AB00345214-03 (CAS 696603-68-6) is a chemical compound with molecular formula C21H26N2O3 and molecular weight 354.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,14-dipropyl-3,12-diazatetracyclo[10.3.1.13,14.05,10]heptadeca-5,7,9-triene-4,11,15-trione
Also Known As: AB00345214-03, A3564/0151171, (2s,4R,6S)-4,6-dipropyl-3,4,6,7-tetrahydro-1H-2,6:4,8-dimethanobenzo[c][1,6]diazacycloundecine-1,5,9-trione, (2S,4S)-4,6-dipropyl-3,4,6,7-tetrahydro-1H-2,6:4,8-dimethanobenzo[c][1,6]diazacycloundecine-1,5,9-trione, 1,14-DIPROPYL-3,12-DIAZATETRACYCLO[10.3.1.1~3,14~.0~5,10~]HEPTADECA-5,7,9-TRIENE-4,11,15-TRIONE
| Molecular Formula | C21H26N2O3 |
|---|---|
| Molecular Weight | 354.19 g/mol |
| LogP | 2.7539 |
| Topological Polar Surface Area | 57.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 354.19434 |
| Heavy Atoms | 26 |
| Complexity | 710.2158 |
Chemical Identifiers
| CAS Number | 696603-68-6 |
|---|---|
| SMILES | CCCC12CN3CC(C1=O)(CN(C2)C(=O)C4=CC=CC=C4C3=O)CCC |
Product Overview
AB00345214-03 (CAS 696603-68-6), with molecular formula C21H26N2O3 and molecular weight 354.19 g/mol. IUPAC: 1,14-dipropyl-3,12-diazatetracyclo[10.3.1.13,14.05,10]heptadeca-5,7,9-triene-4,11,15-trione.
Chemical Property Profile of AB00345214-03
Property Insights of AB00345214-03
The XLogP value of 2.7539 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00345214-03. With a topological polar surface area (TPSA) of 57.69 Ų, AB00345214-03 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB00345214-03 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 AB00345214-03?
The CAS number of AB00345214-03 is 696603-68-6.
What is the molecular formula of AB00345214-03?
The molecular formula of AB00345214-03 is C21H26N2O3.
What is the molecular weight of AB00345214-03?
The molecular weight of AB00345214-03 is 354.19 g/mol.
Where can I buy AB00345214-03?
You can request a quote for AB00345214-03 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00345214-03?
Yes, KEHONG BIO provides custom synthesis services for AB00345214-03 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.