3-亚氨基-3H-吩噻嗪-7-胺
TL;DR: 3-亚氨基-3H-吩噻嗪-7-胺 (CAS 135-59-1) is a chemical compound with molecular formula C12H9N3S and molecular weight 227.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-亚氨基-3H-吩噻嗪-7-胺
7-iminophenothiazin-3-amine
Also Known As: Thionine, Thionin, 3-Imino-3H-phenothiazin-7-amine, 7-iminophenothiazin-3-amine, 3H-Phenothiazin-7-amine, 3-imino-
| Molecular Formula | C12H9N3S |
|---|---|
| Molecular Weight | 227.05 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 87.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 227.05171 |
| Heavy Atoms | 16 |
| Complexity | 422.0 |
Chemical Identifiers
| CAS Number | 135-59-1 |
|---|---|
| SMILES | C1=CC2=C(C=C1N)SC3=CC(=N)C=CC3=N2 |
| InChIKey | SHHZUHVSERGLNW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-亚氨基-3H-吩噻嗪-7-胺 (CAS 135-59-1), with molecular formula C12H9N3S and molecular weight 227.05 g/mol. IUPAC: 7-iminophenothiazin-3-amine.
Chemical Property Profile of 3-亚氨基-3H-吩噻嗪-7-胺
Property Insights of 3-亚氨基-3H-吩噻嗪-7-胺
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-亚氨基-3H-吩噻嗪-7-胺. The TPSA of 87.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-亚氨基-3H-吩噻嗪-7-胺. Following Lipinski's Rule of Five, 3-亚氨基-3H-吩噻嗪-7-胺 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-亚氨基-3H-吩噻嗪-7-胺?
The CAS number of 3-亚氨基-3H-吩噻嗪-7-胺 is 135-59-1.
What is the molecular formula of 3-亚氨基-3H-吩噻嗪-7-胺?
The molecular formula of 3-亚氨基-3H-吩噻嗪-7-胺 is C12H9N3S.
What is the molecular weight of 3-亚氨基-3H-吩噻嗪-7-胺?
The molecular weight of 3-亚氨基-3H-吩噻嗪-7-胺 is 227.05 g/mol.
Where can I buy 3-亚氨基-3H-吩噻嗪-7-胺?
You can request a quote for 3-亚氨基-3H-吩噻嗪-7-胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-亚氨基-3H-吩噻嗪-7-胺?
Yes, KEHONG BIO provides custom synthesis services for 3-亚氨基-3H-吩噻嗪-7-胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.