Thieno(3,2-d)isothiazole-5-carboxamide, 4-amino-3-((phenylmethyl)thio)-
TL;DR: Thieno(3,2-d)isothiazole-5-carboxamide, 4-amino-3-((phenylmethyl)thio)- (CAS 135489-16-6) is a chemical compound with molecular formula C13H11N3OS3 and molecular weight 321.00644 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-amino-3-benzylsulfanylthieno[3,2-d][1,2]thiazole-5-carboxamide
Also Known As: Thieno(3,2-d)isothiazole-5-carboxamide, 4-amino-3-((phenylmethyl)thio)-, 4-Amino-3-((phenylmethyl)thio)thieno(3,2-d)isothiazole-5-carboxamide, 4-amino-3-benzylsulfanylthieno[3,2-d][1,2]thiazole-5-carboxamide, 4-Amino-3-(benzylsulfanyl)thieno[3,2-d][1,2]thiazole-5-carboxamide, BRN 4265164
Technical Specifications
| Molecular Formula | C13H11N3OS3 |
| Molecular Weight | 321.00644 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 164.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 321.00644 Da |
| Heavy Atoms | 20 |
| Complexity | 365.0 |
| SMILES | C1=CC=C(C=C1)CSC2=NSC3=C2C(=C(S3)C(=O)N)N |
| InChIKey | XVMPGHIOPPGVAM-UHFFFAOYSA-N |
Chemical Property Profile of Thieno(3,2-d)isothiazole-5-carboxamide, 4-amino-3-((phenylmethyl)thio)-
Property Insights of Thieno(3,2-d)isothiazole-5-carboxamide, 4-amino-3-((phenylmethyl)thio)-
The XLogP value of 3.8 indicates that Thieno(3,2-d)isothiazole-5-carboxamide, 4-amino-3-((phenylmethyl)thio)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 164.0 Ų indicates high polarity, suggesting Thieno(3,2-d)isothiazole-5-carboxamide, 4-amino-3-((phenylmethyl)thio)- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Thieno(3,2-d)isothiazole-5-carboxamide, 4-amino-3-((phenylmethyl)thio)- has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Thieno(3,2-d)isothiazole-5-carboxamide, 4-amino-3-((phenylmethyl)thio)-?
The CAS number of Thieno(3,2-d)isothiazole-5-carboxamide, 4-amino-3-((phenylmethyl)thio)- is 135489-16-6.
What is the molecular formula of Thieno(3,2-d)isothiazole-5-carboxamide, 4-amino-3-((phenylmethyl)thio)-?
The molecular formula of Thieno(3,2-d)isothiazole-5-carboxamide, 4-amino-3-((phenylmethyl)thio)- is C13H11N3OS3.
What is the molecular weight of Thieno(3,2-d)isothiazole-5-carboxamide, 4-amino-3-((phenylmethyl)thio)-?
The molecular weight of Thieno(3,2-d)isothiazole-5-carboxamide, 4-amino-3-((phenylmethyl)thio)- is 321.00644 g/mol.
Where can I buy Thieno(3,2-d)isothiazole-5-carboxamide, 4-amino-3-((phenylmethyl)thio)-?
You can request a quote for Thieno(3,2-d)isothiazole-5-carboxamide, 4-amino-3-((phenylmethyl)thio)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Thieno(3,2-d)isothiazole-5-carboxamide, 4-amino-3-((phenylmethyl)thio)-?
Yes, CoreyChem provides custom synthesis services for Thieno(3,2-d)isothiazole-5-carboxamide, 4-amino-3-((phenylmethyl)thio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.