![3,11-Dithia-17-azabicyclo[11.3.1]heptadeca-1(17),13,15-triene structure](/static/products/6220/62202-78-2.webp)
3,11-Dithia-17-azabicyclo[11.3.1]heptadeca-1(17),13,15-triene
TL;DR: 3,11-Dithia-17-azabicyclo[11.3.1]heptadeca-1(17),13,15-triene (CAS 62202-78-2) is a chemical compound with molecular formula C14H21NS2 and molecular weight 267.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,11-dithia-17-azabicyclo[11.3.1]heptadeca-1(17),13,15-triene
Also Known As: 3,11-dithia-17-azabicyclo[11.3.1]heptadeca-1(17),13,15-triene, 3,11-dithia-17-azabicyclo[11.3.1]heptadeca-1(17),13,15-trien
| Molecular Formula | C14H21NS2 |
|---|---|
| Molecular Weight | 267.11 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 63.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 267.11154 |
| Heavy Atoms | 17 |
| Complexity | 181.0 |
Chemical Identifiers
| CAS Number | 62202-78-2 |
|---|---|
| SMILES | C1CCCSCC2=NC(=CC=C2)CSCCC1 |
| InChIKey | AQNYSTGEYKUIAE-UHFFFAOYSA-N |
Product Overview
3,11-Dithia-17-azabicyclo[11.3.1]heptadeca-1(17),13,15-triene (CAS 62202-78-2), with molecular formula C14H21NS2 and molecular weight 267.11 g/mol. IUPAC: 3,11-dithia-17-azabicyclo[11.3.1]heptadeca-1(17),13,15-triene.
Chemical Property Profile of 3,11-Dithia-17-azabicyclo[11.3.1]heptadeca-1(17),13,15-triene
Property Insights of 3,11-Dithia-17-azabicyclo[11.3.1]heptadeca-1(17),13,15-triene
The XLogP value of 3.6 indicates that 3,11-Dithia-17-azabicyclo[11.3.1]heptadeca-1(17),13,15-triene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,11-Dithia-17-azabicyclo[11.3.1]heptadeca-1(17),13,15-triene. Following Lipinski's Rule of Five, 3,11-Dithia-17-azabicyclo[11.3.1]heptadeca-1(17),13,15-triene 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 3,11-Dithia-17-azabicyclo[11.3.1]heptadeca-1(17),13,15-triene?
The CAS number of 3,11-Dithia-17-azabicyclo[11.3.1]heptadeca-1(17),13,15-triene is 62202-78-2.
What is the molecular formula of 3,11-Dithia-17-azabicyclo[11.3.1]heptadeca-1(17),13,15-triene?
The molecular formula of 3,11-Dithia-17-azabicyclo[11.3.1]heptadeca-1(17),13,15-triene is C14H21NS2.
What is the molecular weight of 3,11-Dithia-17-azabicyclo[11.3.1]heptadeca-1(17),13,15-triene?
The molecular weight of 3,11-Dithia-17-azabicyclo[11.3.1]heptadeca-1(17),13,15-triene is 267.11 g/mol.
Where can I buy 3,11-Dithia-17-azabicyclo[11.3.1]heptadeca-1(17),13,15-triene?
You can request a quote for 3,11-Dithia-17-azabicyclo[11.3.1]heptadeca-1(17),13,15-triene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,11-Dithia-17-azabicyclo[11.3.1]heptadeca-1(17),13,15-triene?
Yes, KEHONG BIO provides custom synthesis services for 3,11-Dithia-17-azabicyclo[11.3.1]heptadeca-1(17),13,15-triene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.