Thioborinic acid, dipropyl-, 4-methoxyphenyl ester
TL;DR: Thioborinic acid, dipropyl-, 4-methoxyphenyl ester (CAS 64503-45-3) is a chemical compound with molecular formula C13H21BOS and molecular weight 236.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-methoxyphenyl)sulfanyl-dipropylborane
Also Known As: Thioborinic acid, dipropyl-, 4-methoxyphenyl ester, (4-methoxyphenyl)sulfanyl-dipropylborane, Borinic acid,dipropylthio-4-methoxyphenyl ester, [(4-Methoxyphenyl)sulfanyl]di(propyl)borane
| Molecular Formula | C13H21BOS |
|---|---|
| Molecular Weight | 236.14 g/mol |
| LogP | 4.5988 |
| Topological Polar Surface Area | 34.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 236.14061 |
| Heavy Atoms | 16 |
| Complexity | 163.0 |
Chemical Identifiers
| CAS Number | 64503-45-3 |
|---|---|
| SMILES | B(CCC)(CCC)SC1=CC=C(C=C1)OC |
| InChIKey | CYBOATOGMYRONG-UHFFFAOYSA-N |
Product Overview
Thioborinic acid, dipropyl-, 4-methoxyphenyl ester (CAS 64503-45-3), with molecular formula C13H21BOS and molecular weight 236.14 g/mol. IUPAC: (4-methoxyphenyl)sulfanyl-dipropylborane.
Chemical Property Profile of Thioborinic acid, dipropyl-, 4-methoxyphenyl ester
Property Insights of Thioborinic acid, dipropyl-, 4-methoxyphenyl ester
The XLogP value of 4.5988 indicates that Thioborinic acid, dipropyl-, 4-methoxyphenyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.5 Ų, Thioborinic acid, dipropyl-, 4-methoxyphenyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Thioborinic acid, dipropyl-, 4-methoxyphenyl ester has 0 hydrogen bond donor(s) and 2 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 Thioborinic acid, dipropyl-, 4-methoxyphenyl ester?
The CAS number of Thioborinic acid, dipropyl-, 4-methoxyphenyl ester is 64503-45-3.
What is the molecular formula of Thioborinic acid, dipropyl-, 4-methoxyphenyl ester?
The molecular formula of Thioborinic acid, dipropyl-, 4-methoxyphenyl ester is C13H21BOS.
What is the molecular weight of Thioborinic acid, dipropyl-, 4-methoxyphenyl ester?
The molecular weight of Thioborinic acid, dipropyl-, 4-methoxyphenyl ester is 236.14 g/mol.
Where can I buy Thioborinic acid, dipropyl-, 4-methoxyphenyl ester?
You can request a quote for Thioborinic acid, dipropyl-, 4-methoxyphenyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thioborinic acid, dipropyl-, 4-methoxyphenyl ester?
Yes, KEHONG BIO provides custom synthesis services for Thioborinic acid, dipropyl-, 4-methoxyphenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.