AB00674909-01
TL;DR: AB00674909-01 (CAS 866349-46-4) is a chemical compound with molecular formula C27H23N3O2 and molecular weight 421.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(3,4-dimethylphenyl)-8-[(4-methylphenyl)methyl]-12,14-dioxa-3,4,8-triazatetracyclo[7.7.0.02,6.011,15]hexadeca-1(16),2,4,6,9,11(15)-hexaene
Also Known As: AB00674909-01, F1603-0030, 3-(3,4-dimethylphenyl)-5-(4-methylbenzyl)-5H-[1,3]dioxolo[4,5-g]pyrazolo[4,3-c]quinoline, 5-(3,4-dimethylphenyl)-8-[(4-methylphenyl)methyl]-12,14-dioxa-3,4,8-triazatetracyclo[7.7.0.0^{2,6}.0^{11,15}]hexadeca-1(16),2,4,6,9,11(15)-hexaene, 5-(3,4-dimethylphenyl)-8-[(4-methylphenyl)methyl]-12,14-dioxa-3,4,8-triazatetracyclo[7.7.0.02,6.011,15]hexadeca-1(16),2,4,6,9,11(15)-hexaene
| Molecular Formula | C27H23N3O2 |
|---|---|
| Molecular Weight | 421.18 g/mol |
| LogP | 5.90536 |
| Topological Polar Surface Area | 49.17 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 421.17902 |
| Heavy Atoms | 32 |
| Complexity | 1450.6158 |
Chemical Identifiers
| CAS Number | 866349-46-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CN2C=C3C(=NN=C3C4=CC5=C(C=C42)OCO5)C6=CC(=C(C=C6)C)C |
Product Overview
AB00674909-01 (CAS 866349-46-4), with molecular formula C27H23N3O2 and molecular weight 421.18 g/mol. IUPAC: 5-(3,4-dimethylphenyl)-8-[(4-methylphenyl)methyl]-12,14-dioxa-3,4,8-triazatetracyclo[7.7.0.02,6.011,15]hexadeca-1(16),2,4,6,9,11(15)-hexaene.
Chemical Property Profile of AB00674909-01
Property Insights of AB00674909-01
The XLogP value of 5.90536 indicates that AB00674909-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.17 Ų, AB00674909-01 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB00674909-01 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AB00674909-01?
The CAS number of AB00674909-01 is 866349-46-4.
What is the molecular formula of AB00674909-01?
The molecular formula of AB00674909-01 is C27H23N3O2.
What is the molecular weight of AB00674909-01?
The molecular weight of AB00674909-01 is 421.18 g/mol.
Where can I buy AB00674909-01?
You can request a quote for AB00674909-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00674909-01?
Yes, KEHONG BIO provides custom synthesis services for AB00674909-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.