Carbamimidothioic acid, 3-(trimethoxysilyl)propyl ester, monohydrochloride
TL;DR: Carbamimidothioic acid, 3-(trimethoxysilyl)propyl ester, monohydrochloride (CAS 58505-58-1) is a chemical compound with molecular formula C7H19ClN2O3SSi and molecular weight 274.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-trimethoxysilylpropyl carbamimidothioate;hydrochloride
Also Known As: Trimethoxysilylpropylisothiouronium chloride, Carbamimidothioic acid, 3-(trimethoxysilyl)propyl ester, monohydrochloride, 2-(3-(Trimethoxysilyl)propyl)isothiouronium chloride, 2-(3-trimethoxysilylpropyl)isothiourea;hydrochloride, 2-[3-(trimethoxysilyl)propyl]isothiouronium chloride
| Molecular Formula | C7H19ClN2O3SSi |
|---|---|
| Molecular Weight | 274.06 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 103.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 274.0574 |
| Heavy Atoms | 15 |
| Complexity | 170.0 |
Chemical Identifiers
| CAS Number | 58505-58-1 |
|---|---|
| SMILES | CO[Si](CCCSC(=N)N)(OC)OC.Cl |
| InChIKey | BCZMKSMVRLGRFS-UHFFFAOYSA-N |
Product Overview
Carbamimidothioic acid, 3-(trimethoxysilyl)propyl ester, monohydrochloride (CAS 58505-58-1), with molecular formula C7H19ClN2O3SSi and molecular weight 274.06 g/mol. IUPAC: 3-trimethoxysilylpropyl carbamimidothioate;hydrochloride.
Chemical Property Profile of Carbamimidothioic acid, 3-(trimethoxysilyl)propyl ester, monohydrochloride
Property Insights of Carbamimidothioic acid, 3-(trimethoxysilyl)propyl ester, monohydrochloride
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbamimidothioic acid, 3-(trimethoxysilyl)propyl ester, monohydrochloride. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Carbamimidothioic acid, 3-(trimethoxysilyl)propyl ester, monohydrochloride. Following Lipinski's Rule of Five, Carbamimidothioic acid, 3-(trimethoxysilyl)propyl ester, monohydrochloride has 3 hydrogen bond donor(s) and 5 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 Carbamimidothioic acid, 3-(trimethoxysilyl)propyl ester, monohydrochloride?
The CAS number of Carbamimidothioic acid, 3-(trimethoxysilyl)propyl ester, monohydrochloride is 58505-58-1.
What is the molecular formula of Carbamimidothioic acid, 3-(trimethoxysilyl)propyl ester, monohydrochloride?
The molecular formula of Carbamimidothioic acid, 3-(trimethoxysilyl)propyl ester, monohydrochloride is C7H19ClN2O3SSi.
What is the molecular weight of Carbamimidothioic acid, 3-(trimethoxysilyl)propyl ester, monohydrochloride?
The molecular weight of Carbamimidothioic acid, 3-(trimethoxysilyl)propyl ester, monohydrochloride is 274.06 g/mol.
Where can I buy Carbamimidothioic acid, 3-(trimethoxysilyl)propyl ester, monohydrochloride?
You can request a quote for Carbamimidothioic acid, 3-(trimethoxysilyl)propyl ester, monohydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbamimidothioic acid, 3-(trimethoxysilyl)propyl ester, monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Carbamimidothioic acid, 3-(trimethoxysilyl)propyl ester, monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.