Tricycloquinazoline, 3,8-difluoro-
TL;DR: Tricycloquinazoline, 3,8-difluoro- (CAS 314-04-5) is a chemical compound with molecular formula C21H10F2N4 and molecular weight 356.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,12-difluoro-8,16,24,25-tetrazahexacyclo[15.7.1.02,7.09,25.010,15.018,23]pentacosa-1(24),2(7),3,5,8,10(15),11,13,16,18,20,22-dodecaene
Also Known As: 3,8-Difluorotricycloquinazoline, Tricycloquinazoline, 3,8-difluoro-, 3,8-Difluoro-5,10,14c,15-tetraazanaphtho[1,2,3-gh]tetraphene, 4,12-difluoro-8,16,24,25-tetraazahexacyclo[15.7.1.02,7.09,25.010,15.018,23]pentacosa-1(24),2,4,6,8,10,12,14,16,18,20,22-dodecaene, BRN 0578908
| Molecular Formula | C21H10F2N4 |
|---|---|
| Molecular Weight | 356.09 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 40.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 356.08734 |
| Heavy Atoms | 27 |
| Complexity | 732.0 |
Chemical Identifiers
| CAS Number | 314-04-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C3=NC4=C(C=C(C=C4)F)C5=NC6=C(C=C(C=C6)F)C(=N2)N35 |
| InChIKey | VLVFOIKZRUFWDM-UHFFFAOYSA-N |
Product Overview
Tricycloquinazoline, 3,8-difluoro- (CAS 314-04-5), with molecular formula C21H10F2N4 and molecular weight 356.09 g/mol. IUPAC: 4,12-difluoro-8,16,24,25-tetrazahexacyclo[15.7.1.02,7.09,25.010,15.018,23]pentacosa-1(24),2(7),3,5,8,10(15),11,13,16,18,20,22-dodecaene.
Chemical Property Profile of Tricycloquinazoline, 3,8-difluoro-
Property Insights of Tricycloquinazoline, 3,8-difluoro-
The XLogP value of 5.2 indicates that Tricycloquinazoline, 3,8-difluoro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.3 Ų, Tricycloquinazoline, 3,8-difluoro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tricycloquinazoline, 3,8-difluoro- has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Tricycloquinazoline, 3,8-difluoro-?
The CAS number of Tricycloquinazoline, 3,8-difluoro- is 314-04-5.
What is the molecular formula of Tricycloquinazoline, 3,8-difluoro-?
The molecular formula of Tricycloquinazoline, 3,8-difluoro- is C21H10F2N4.
What is the molecular weight of Tricycloquinazoline, 3,8-difluoro-?
The molecular weight of Tricycloquinazoline, 3,8-difluoro- is 356.09 g/mol.
Where can I buy Tricycloquinazoline, 3,8-difluoro-?
You can request a quote for Tricycloquinazoline, 3,8-difluoro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tricycloquinazoline, 3,8-difluoro-?
Yes, KEHONG BIO provides custom synthesis services for Tricycloquinazoline, 3,8-difluoro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.