S-(5-methyl-1,3,4-thiadiazol-2-yl) 10H-phenothiazine-10-carbothioate
TL;DR: S-(5-methyl-1,3,4-thiadiazol-2-yl) 10H-phenothiazine-10-carbothioate (CAS 384798-38-3) is a chemical compound with molecular formula C16H11N3OS3 and molecular weight 357.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
S-(5-methyl-1,3,4-thiadiazol-2-yl) phenothiazine-10-carbothioate
Also Known As: ChemDiv3_003793, BAS 03450527, IDI1_021703, BRD-K21768991-001-01-1, Phenothiazine-10-carbothioic acid S-(5-methyl-[1,3,4]thiadiazol-2-yl) ester
| Molecular Formula | C16H11N3OS3 |
|---|---|
| Molecular Weight | 357.01 g/mol |
| LogP | 5.36152 |
| Topological Polar Surface Area | 46.09 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 357.00644 |
| Heavy Atoms | 23 |
| Complexity | 848.0368 |
Chemical Identifiers
| CAS Number | 384798-38-3 |
|---|---|
| SMILES | CC1=NN=C(S1)SC(=O)N2C3=CC=CC=C3SC4=CC=CC=C42 |
Product Overview
S-(5-methyl-1,3,4-thiadiazol-2-yl) 10H-phenothiazine-10-carbothioate (CAS 384798-38-3), with molecular formula C16H11N3OS3 and molecular weight 357.01 g/mol. IUPAC: S-(5-methyl-1,3,4-thiadiazol-2-yl) phenothiazine-10-carbothioate.
Chemical Property Profile of S-(5-methyl-1,3,4-thiadiazol-2-yl) 10H-phenothiazine-10-carbothioate
Property Insights of S-(5-methyl-1,3,4-thiadiazol-2-yl) 10H-phenothiazine-10-carbothioate
The XLogP value of 5.36152 indicates that S-(5-methyl-1,3,4-thiadiazol-2-yl) 10H-phenothiazine-10-carbothioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.09 Ų, S-(5-methyl-1,3,4-thiadiazol-2-yl) 10H-phenothiazine-10-carbothioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, S-(5-methyl-1,3,4-thiadiazol-2-yl) 10H-phenothiazine-10-carbothioate has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of S-(5-methyl-1,3,4-thiadiazol-2-yl) 10H-phenothiazine-10-carbothioate?
The CAS number of S-(5-methyl-1,3,4-thiadiazol-2-yl) 10H-phenothiazine-10-carbothioate is 384798-38-3.
What is the molecular formula of S-(5-methyl-1,3,4-thiadiazol-2-yl) 10H-phenothiazine-10-carbothioate?
The molecular formula of S-(5-methyl-1,3,4-thiadiazol-2-yl) 10H-phenothiazine-10-carbothioate is C16H11N3OS3.
What is the molecular weight of S-(5-methyl-1,3,4-thiadiazol-2-yl) 10H-phenothiazine-10-carbothioate?
The molecular weight of S-(5-methyl-1,3,4-thiadiazol-2-yl) 10H-phenothiazine-10-carbothioate is 357.01 g/mol.
Where can I buy S-(5-methyl-1,3,4-thiadiazol-2-yl) 10H-phenothiazine-10-carbothioate?
You can request a quote for S-(5-methyl-1,3,4-thiadiazol-2-yl) 10H-phenothiazine-10-carbothioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S-(5-methyl-1,3,4-thiadiazol-2-yl) 10H-phenothiazine-10-carbothioate?
Yes, KEHONG BIO provides custom synthesis services for S-(5-methyl-1,3,4-thiadiazol-2-yl) 10H-phenothiazine-10-carbothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.