3-Nitro-10H-phenothiazine
TL;DR: 3-Nitro-10H-phenothiazine (CAS 1628-77-9) is a chemical compound with molecular formula C12H8N2O2S and molecular weight 244.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-nitro-10H-phenothiazine
Also Known As: 3-nitro-10H-phenothiazine, 3-nitrophenothiazine, Methylene blue Impurity 4, 10H-Phenothiazine, 3-nitro-, NCI60_026698
| Molecular Formula | C12H8N2O2S |
|---|---|
| Molecular Weight | 244.03 g/mol |
| LogP | 3.803 |
| Topological Polar Surface Area | 55.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 244.03065 |
| Heavy Atoms | 17 |
| Complexity | 613.20465 |
Chemical Identifiers
| CAS Number | 1628-77-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)NC3=C(S2)C=C(C=C3)[N+](=O)[O-] |
Product Overview
3-Nitro-10H-phenothiazine (CAS 1628-77-9), with molecular formula C12H8N2O2S and molecular weight 244.03 g/mol. IUPAC: 3-nitro-10H-phenothiazine.
Chemical Property Profile of 3-Nitro-10H-phenothiazine
Property Insights of 3-Nitro-10H-phenothiazine
The XLogP value of 3.803 indicates that 3-Nitro-10H-phenothiazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.17 Ų, 3-Nitro-10H-phenothiazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Nitro-10H-phenothiazine has 1 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-Nitro-10H-phenothiazine?
The CAS number of 3-Nitro-10H-phenothiazine is 1628-77-9.
What is the molecular formula of 3-Nitro-10H-phenothiazine?
The molecular formula of 3-Nitro-10H-phenothiazine is C12H8N2O2S.
What is the molecular weight of 3-Nitro-10H-phenothiazine?
The molecular weight of 3-Nitro-10H-phenothiazine is 244.03 g/mol.
Where can I buy 3-Nitro-10H-phenothiazine?
You can request a quote for 3-Nitro-10H-phenothiazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Nitro-10H-phenothiazine?
Yes, KEHONG BIO provides custom synthesis services for 3-Nitro-10H-phenothiazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.