十八烷基氨基硫代亚胺甲酸酯
TL;DR: 十八烷基氨基硫代亚胺甲酸酯 (CAS 45270-09-5) is a chemical compound with molecular formula C19H40N2S and molecular weight 328.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
十八烷基氨基硫代亚胺甲酸酯
octadecyl carbamimidothioate
Also Known As: S-Octadecylthiourea, 2-Stearyl-2-thiopsuedourea, octadecyl carbamimidothioate, Carbamimidothioic acid, octadecyl ester, (octadecylsulfanyl)methanimidamide
| Molecular Formula | C19H40N2S |
|---|---|
| Molecular Weight | 328.29 g/mol |
| LogP | 9.0 |
| Topological Polar Surface Area | 75.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 18 |
| Exact Mass | 328.29123 |
| Heavy Atoms | 22 |
| Complexity | 231.0 |
Chemical Identifiers
| CAS Number | 45270-09-5 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCCSC(=N)N |
| InChIKey | IQYGWEPIBFAIEX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
十八烷基氨基硫代亚胺甲酸酯 (CAS 45270-09-5), with molecular formula C19H40N2S and molecular weight 328.29 g/mol. IUPAC: octadecyl carbamimidothioate.
Chemical Property Profile of 十八烷基氨基硫代亚胺甲酸酯
Property Insights of 十八烷基氨基硫代亚胺甲酸酯
The XLogP value of 9.0 indicates that 十八烷基氨基硫代亚胺甲酸酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 十八烷基氨基硫代亚胺甲酸酯. Following Lipinski's Rule of Five, 十八烷基氨基硫代亚胺甲酸酯 has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 十八烷基氨基硫代亚胺甲酸酯?
The CAS number of 十八烷基氨基硫代亚胺甲酸酯 is 45270-09-5.
What is the molecular formula of 十八烷基氨基硫代亚胺甲酸酯?
The molecular formula of 十八烷基氨基硫代亚胺甲酸酯 is C19H40N2S.
What is the molecular weight of 十八烷基氨基硫代亚胺甲酸酯?
The molecular weight of 十八烷基氨基硫代亚胺甲酸酯 is 328.29 g/mol.
Where can I buy 十八烷基氨基硫代亚胺甲酸酯?
You can request a quote for 十八烷基氨基硫代亚胺甲酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 十八烷基氨基硫代亚胺甲酸酯?
Yes, KEHONG BIO provides custom synthesis services for 十八烷基氨基硫代亚胺甲酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.