Naphtho(1,8-cd)-1,2-thiaselenole
TL;DR: Naphtho(1,8-cd)-1,2-thiaselenole (CAS 64869-35-8) is a chemical compound with molecular formula C10H6SSe and molecular weight 237.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-thia-3-selenatricyclo[6.3.1.04,12]dodeca-1(11),4,6,8(12),9-pentaene
Also Known As: Naphtho[1,8-cd]-1,2-thiaselenole, Naphtho(1,8-cd)-1,2-thiaselenole, 1-Selena-2-thiaacenaphthene, 1-Thia-2-selenaacenaphthene, naphtho<1,8-cd>thiaselenole
| Molecular Formula | C10H6SSe |
|---|---|
| Molecular Weight | 237.94 g/mol |
| LogP | 2.19 |
| Topological Polar Surface Area | 25.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 237.93555 |
| Heavy Atoms | 12 |
| Complexity | 183.0 |
Chemical Identifiers
| CAS Number | 64869-35-8 |
|---|---|
| SMILES | C1=CC2=C3C(=C1)S[Se]C3=CC=C2 |
| InChIKey | CNVRUDFAIBEQAB-UHFFFAOYSA-N |
Product Overview
Naphtho(1,8-cd)-1,2-thiaselenole (CAS 64869-35-8), with molecular formula C10H6SSe and molecular weight 237.94 g/mol. IUPAC: 2-thia-3-selenatricyclo[6.3.1.04,12]dodeca-1(11),4,6,8(12),9-pentaene.
Chemical Property Profile of Naphtho(1,8-cd)-1,2-thiaselenole
Property Insights of Naphtho(1,8-cd)-1,2-thiaselenole
The XLogP value of 2.19 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Naphtho(1,8-cd)-1,2-thiaselenole. With a topological polar surface area (TPSA) of 25.3 Ų, Naphtho(1,8-cd)-1,2-thiaselenole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Naphtho(1,8-cd)-1,2-thiaselenole has 0 hydrogen bond donor(s) and 1 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 Naphtho(1,8-cd)-1,2-thiaselenole?
The CAS number of Naphtho(1,8-cd)-1,2-thiaselenole is 64869-35-8.
What is the molecular formula of Naphtho(1,8-cd)-1,2-thiaselenole?
The molecular formula of Naphtho(1,8-cd)-1,2-thiaselenole is C10H6SSe.
What is the molecular weight of Naphtho(1,8-cd)-1,2-thiaselenole?
The molecular weight of Naphtho(1,8-cd)-1,2-thiaselenole is 237.94 g/mol.
Where can I buy Naphtho(1,8-cd)-1,2-thiaselenole?
You can request a quote for Naphtho(1,8-cd)-1,2-thiaselenole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Naphtho(1,8-cd)-1,2-thiaselenole?
Yes, KEHONG BIO provides custom synthesis services for Naphtho(1,8-cd)-1,2-thiaselenole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.