5,7-dimethyl-3-phenyl-3H-pyrido[4,3,2-de]quinazoline
TL;DR: 5,7-dimethyl-3-phenyl-3H-pyrido[4,3,2-de]quinazoline (CAS 5787-10-0) is a chemical compound with molecular formula C18H15N3 and molecular weight 273.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7,10-dimethyl-4-phenyl-2,4,8-triazatricyclo[7.3.1.05,13]trideca-1(13),2,5,7,9,11-hexaene
Also Known As: 5,7-dimethyl-3-phenyl-3H-pyrido[4,3,2-de]quinazoline, BIM-0033091.P001, AF-936/31271053, 7,10-dimethyl-4-phenyl-2,4,8-triazatricyclo[7.3.1.05,13]trideca-1(13),2,5,7,9,11-hexaene
| Molecular Formula | C18H15N3 |
|---|---|
| Molecular Weight | 273.13 g/mol |
| LogP | 4.66314 |
| Topological Polar Surface Area | 28.49 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 273.1266 |
| Heavy Atoms | 21 |
| Complexity | 866.51587 |
Chemical Identifiers
| CAS Number | 5787-10-0 |
|---|---|
| SMILES | CC1=C2C3=C(C=C1)N=CN(C3=CC(=N2)C)C4=CC=CC=C4 |
Product Overview
5,7-dimethyl-3-phenyl-3H-pyrido[4,3,2-de]quinazoline (CAS 5787-10-0), with molecular formula C18H15N3 and molecular weight 273.13 g/mol. IUPAC: 7,10-dimethyl-4-phenyl-2,4,8-triazatricyclo[7.3.1.05,13]trideca-1(13),2,5,7,9,11-hexaene.
Chemical Property Profile of 5,7-dimethyl-3-phenyl-3H-pyrido[4,3,2-de]quinazoline
Property Insights of 5,7-dimethyl-3-phenyl-3H-pyrido[4,3,2-de]quinazoline
The XLogP value of 4.66314 indicates that 5,7-dimethyl-3-phenyl-3H-pyrido[4,3,2-de]quinazoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.49 Ų, 5,7-dimethyl-3-phenyl-3H-pyrido[4,3,2-de]quinazoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,7-dimethyl-3-phenyl-3H-pyrido[4,3,2-de]quinazoline 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 5,7-dimethyl-3-phenyl-3H-pyrido[4,3,2-de]quinazoline?
The CAS number of 5,7-dimethyl-3-phenyl-3H-pyrido[4,3,2-de]quinazoline is 5787-10-0.
What is the molecular formula of 5,7-dimethyl-3-phenyl-3H-pyrido[4,3,2-de]quinazoline?
The molecular formula of 5,7-dimethyl-3-phenyl-3H-pyrido[4,3,2-de]quinazoline is C18H15N3.
What is the molecular weight of 5,7-dimethyl-3-phenyl-3H-pyrido[4,3,2-de]quinazoline?
The molecular weight of 5,7-dimethyl-3-phenyl-3H-pyrido[4,3,2-de]quinazoline is 273.13 g/mol.
Where can I buy 5,7-dimethyl-3-phenyl-3H-pyrido[4,3,2-de]quinazoline?
You can request a quote for 5,7-dimethyl-3-phenyl-3H-pyrido[4,3,2-de]quinazoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,7-dimethyl-3-phenyl-3H-pyrido[4,3,2-de]quinazoline?
Yes, KEHONG BIO provides custom synthesis services for 5,7-dimethyl-3-phenyl-3H-pyrido[4,3,2-de]quinazoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.