Thiazole, 2,4-diamino-5-phenyl-, benzenesulfonate
TL;DR: Thiazole, 2,4-diamino-5-phenyl-, benzenesulfonate (CAS 5894-03-1) is a chemical compound with molecular formula C15H15N3O3S2 and molecular weight 349.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzenesulfonic acid;5-phenyl-1,3-thiazole-2,4-diamine
Also Known As: 2,4-Diamino-5-phenylthiazole benzenesulfonate, Thiazole, 2,4-diamino-5-phenyl-, benzenesulfonate, Benzenesulfonate of 2,4-diamino-5-phenylthiazole, 2,4-Thiazolediamine, 5-phenyl-, benzenesulfonate, Benzenesulfonic acid,4-thiazolediamine (1:1)
| Molecular Formula | C15H15N3O3S2 |
|---|---|
| Molecular Weight | 349.06 g/mol |
| LogP | 2.9078 |
| Topological Polar Surface Area | 156.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 349.05548 |
| Heavy Atoms | 23 |
| Complexity | 354.0 |
Chemical Identifiers
| CAS Number | 5894-03-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=C(N=C(S2)N)N.C1=CC=C(C=C1)S(=O)(=O)O |
| InChIKey | WIYRYNULUZVVFY-UHFFFAOYSA-N |
Product Overview
Thiazole, 2,4-diamino-5-phenyl-, benzenesulfonate (CAS 5894-03-1), with molecular formula C15H15N3O3S2 and molecular weight 349.06 g/mol. IUPAC: benzenesulfonic acid;5-phenyl-1,3-thiazole-2,4-diamine.
Chemical Property Profile of Thiazole, 2,4-diamino-5-phenyl-, benzenesulfonate
Property Insights of Thiazole, 2,4-diamino-5-phenyl-, benzenesulfonate
The XLogP value of 2.9078 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Thiazole, 2,4-diamino-5-phenyl-, benzenesulfonate. The TPSA of 156.0 Ų indicates high polarity, suggesting Thiazole, 2,4-diamino-5-phenyl-, benzenesulfonate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Thiazole, 2,4-diamino-5-phenyl-, benzenesulfonate has 3 hydrogen bond donor(s) and 7 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 Thiazole, 2,4-diamino-5-phenyl-, benzenesulfonate?
The CAS number of Thiazole, 2,4-diamino-5-phenyl-, benzenesulfonate is 5894-03-1.
What is the molecular formula of Thiazole, 2,4-diamino-5-phenyl-, benzenesulfonate?
The molecular formula of Thiazole, 2,4-diamino-5-phenyl-, benzenesulfonate is C15H15N3O3S2.
What is the molecular weight of Thiazole, 2,4-diamino-5-phenyl-, benzenesulfonate?
The molecular weight of Thiazole, 2,4-diamino-5-phenyl-, benzenesulfonate is 349.06 g/mol.
Where can I buy Thiazole, 2,4-diamino-5-phenyl-, benzenesulfonate?
You can request a quote for Thiazole, 2,4-diamino-5-phenyl-, benzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thiazole, 2,4-diamino-5-phenyl-, benzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for Thiazole, 2,4-diamino-5-phenyl-, benzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.