3,7-二氨基二苯并噻吩-5,5-二氧化物
TL;DR: 3,7-二氨基二苯并噻吩-5,5-二氧化物 (CAS 6259-19-4) is a chemical compound with molecular formula C12H10N2O2S and molecular weight 246.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,7-二氨基二苯并噻吩-5,5-二氧化物
5,5-dioxodibenzothiophene-3,7-diamine
Also Known As: Benzidine sulfone, USAF ND-67, 3,7-Diaminodibenzo[b,d]thiophene 5,5-dioxide, 3,7-Diaminodiphenylene sulfone, 2,7-Diaminodiphenylenesulfone
| Molecular Formula | C12H10N2O2S |
|---|---|
| Molecular Weight | 246.05 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 94.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 246.0463 |
| Heavy Atoms | 17 |
| Complexity | 371.0 |
Chemical Identifiers
| CAS Number | 6259-19-4 |
|---|---|
| SMILES | C1=CC2=C(C=C1N)S(=O)(=O)C3=C2C=CC(=C3)N |
| InChIKey | FUXZRRZSHWQAAA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,7-二氨基二苯并噻吩-5,5-二氧化物 (CAS 6259-19-4), with molecular formula C12H10N2O2S and molecular weight 246.05 g/mol. IUPAC: 5,5-dioxodibenzothiophene-3,7-diamine.
Chemical Property Profile of 3,7-二氨基二苯并噻吩-5,5-二氧化物
Property Insights of 3,7-二氨基二苯并噻吩-5,5-二氧化物
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,7-二氨基二苯并噻吩-5,5-二氧化物. The TPSA of 94.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,7-二氨基二苯并噻吩-5,5-二氧化物. Following Lipinski's Rule of Five, 3,7-二氨基二苯并噻吩-5,5-二氧化物 has 2 hydrogen bond donor(s) and 4 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 3,7-二氨基二苯并噻吩-5,5-二氧化物?
The CAS number of 3,7-二氨基二苯并噻吩-5,5-二氧化物 is 6259-19-4.
What is the molecular formula of 3,7-二氨基二苯并噻吩-5,5-二氧化物?
The molecular formula of 3,7-二氨基二苯并噻吩-5,5-二氧化物 is C12H10N2O2S.
What is the molecular weight of 3,7-二氨基二苯并噻吩-5,5-二氧化物?
The molecular weight of 3,7-二氨基二苯并噻吩-5,5-二氧化物 is 246.05 g/mol.
Where can I buy 3,7-二氨基二苯并噻吩-5,5-二氧化物?
You can request a quote for 3,7-二氨基二苯并噻吩-5,5-二氧化物 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,7-二氨基二苯并噻吩-5,5-二氧化物?
Yes, KEHONG BIO provides custom synthesis services for 3,7-二氨基二苯并噻吩-5,5-二氧化物 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.