萘并(1,2-d)-1,3-噁噻咯-2-酮
TL;DR: 萘并(1,2-d)-1,3-噁噻咯-2-酮 (CAS 15137-41-4) is a chemical compound with molecular formula C11H6O2S and molecular weight 202.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
萘并(1,2-d)-1,3-噁噻咯-2-酮
benzo[g][1,3]benzoxathiol-2-one
Also Known As: Naphtho(1,2-d)-1,3-oxathiol-2-one, benzo[g][1,3]benzoxathiol-2-one, Naphtho[1,2-d]-1,3-oxathiol-2-one, 2H-naphtho[2,1-d][1,3]oxathiol-2-one, naphtho[2,1-d]1,3-oxathiolen-2-one
| Molecular Formula | C11H6O2S |
|---|---|
| Molecular Weight | 202.01 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 51.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 202.00885 |
| Heavy Atoms | 14 |
| Complexity | 254.0 |
Chemical Identifiers
| CAS Number | 15137-41-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC3=C2OC(=O)S3 |
| InChIKey | SBBNJDGLGLZRGN-UHFFFAOYSA-N |
Product Overview
萘并(1,2-d)-1,3-噁噻咯-2-酮 (CAS 15137-41-4), with molecular formula C11H6O2S and molecular weight 202.01 g/mol. IUPAC: benzo[g][1,3]benzoxathiol-2-one.
Chemical Property Profile of 萘并(1,2-d)-1,3-噁噻咯-2-酮
Property Insights of 萘并(1,2-d)-1,3-噁噻咯-2-酮
The XLogP value of 3.5 indicates that 萘并(1,2-d)-1,3-噁噻咯-2-酮 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.6 Ų, 萘并(1,2-d)-1,3-噁噻咯-2-酮 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 萘并(1,2-d)-1,3-噁噻咯-2-酮 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 萘并(1,2-d)-1,3-噁噻咯-2-酮?
The CAS number of 萘并(1,2-d)-1,3-噁噻咯-2-酮 is 15137-41-4.
What is the molecular formula of 萘并(1,2-d)-1,3-噁噻咯-2-酮?
The molecular formula of 萘并(1,2-d)-1,3-噁噻咯-2-酮 is C11H6O2S.
What is the molecular weight of 萘并(1,2-d)-1,3-噁噻咯-2-酮?
The molecular weight of 萘并(1,2-d)-1,3-噁噻咯-2-酮 is 202.01 g/mol.
Where can I buy 萘并(1,2-d)-1,3-噁噻咯-2-酮?
You can request a quote for 萘并(1,2-d)-1,3-噁噻咯-2-酮 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 萘并(1,2-d)-1,3-噁噻咯-2-酮?
Yes, KEHONG BIO provides custom synthesis services for 萘并(1,2-d)-1,3-噁噻咯-2-酮 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.