![phenyl[?] structure](/static/products/7239/72397-25-2.webp)
phenyl[?]
TL;DR: phenyl[?] (CAS 72397-25-2) is a chemical compound with molecular formula C18H13N3S2 and molecular weight 335.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
17-phenyl-8,16-dithia-6,14,17-triazatetracyclo[7.7.1.02,7.010,15]heptadeca-2(7),3,5,10(15),11,13-hexaene
Also Known As: phenyl[?], 17-phenyl-8,16-dithia-6,14,17-triazatetracyclo[7.7.1.0~2,7~.0~10,15~]heptadeca-2,4,6,10,12,14-hexaene, AE-411/41415591, 17-Phenyl-8,16-dithia-6,14,17-triazatetracyclo[7.7.1.02,7.010,15]heptadeca-2(7),3,5,10(15),11,13-hexaene, 13-phenyl-5H,11H-5,11-epiazano-[1,5]dithiocino[2,3-b,6,7-b']
| Molecular Formula | C18H13N3S2 |
|---|---|
| Molecular Weight | 335.06 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 79.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 335.05508 |
| Heavy Atoms | 23 |
| Complexity | 398.0 |
Chemical Identifiers
| CAS Number | 72397-25-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C3C4=C(N=CC=C4)SC2C5=C(S3)N=CC=C5 |
| InChIKey | RLVYHVVWFIJYPG-UHFFFAOYSA-N |
Product Overview
phenyl[?] (CAS 72397-25-2), with molecular formula C18H13N3S2 and molecular weight 335.06 g/mol. IUPAC: 17-phenyl-8,16-dithia-6,14,17-triazatetracyclo[7.7.1.02,7.010,15]heptadeca-2(7),3,5,10(15),11,13-hexaene.
Chemical Property Profile of phenyl[?]
Property Insights of phenyl[?]
The XLogP value of 4.4 indicates that phenyl[?] is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.6 Ų falls within the moderate polarity range, balancing permeability and solubility for phenyl[?]. Following Lipinski's Rule of Five, phenyl[?] has 0 hydrogen bond donor(s) and 5 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 phenyl[?]?
The CAS number of phenyl[?] is 72397-25-2.
What is the molecular formula of phenyl[?]?
The molecular formula of phenyl[?] is C18H13N3S2.
What is the molecular weight of phenyl[?]?
The molecular weight of phenyl[?] is 335.06 g/mol.
Where can I buy phenyl[?]?
You can request a quote for phenyl[?] directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for phenyl[?]?
Yes, KEHONG BIO provides custom synthesis services for phenyl[?] and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.