S-(3-氯丙基)硫代氨基甲酸酯
TL;DR: S-(3-氯丙基)硫代氨基甲酸酯 (CAS 17494-72-3) is a chemical compound with molecular formula C4H8ClNOS and molecular weight 153.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
S-(3-氯丙基)硫代氨基甲酸酯
S-(3-chloropropyl) carbamothioate
Also Known As: 3-Chloropropyl thiocarbamate, S-(3-chloropropyl) carbamothioate, 3-Chloropropyl thiolcarbamate, Carbamothioic acid, S-(3-chloropropyl) ester, [(3-chloropropyl)sulfanyl]formamide
| Molecular Formula | C4H8ClNOS |
|---|---|
| Molecular Weight | 153.00 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 68.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 153.00151 |
| Heavy Atoms | 8 |
| Complexity | 78.0 |
Chemical Identifiers
| CAS Number | 17494-72-3 |
|---|---|
| SMILES | C(CSC(=O)N)CCl |
| InChIKey | YUZPIPRFWMDPBQ-UHFFFAOYSA-N |
Product Overview
S-(3-氯丙基)硫代氨基甲酸酯 (CAS 17494-72-3), with molecular formula C4H8ClNOS and molecular weight 153.00 g/mol. IUPAC: S-(3-chloropropyl) carbamothioate.
Chemical Property Profile of S-(3-氯丙基)硫代氨基甲酸酯
Property Insights of S-(3-氯丙基)硫代氨基甲酸酯
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for S-(3-氯丙基)硫代氨基甲酸酯. The TPSA of 68.4 Ų falls within the moderate polarity range, balancing permeability and solubility for S-(3-氯丙基)硫代氨基甲酸酯. Following Lipinski's Rule of Five, S-(3-氯丙基)硫代氨基甲酸酯 has 1 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 S-(3-氯丙基)硫代氨基甲酸酯?
The CAS number of S-(3-氯丙基)硫代氨基甲酸酯 is 17494-72-3.
What is the molecular formula of S-(3-氯丙基)硫代氨基甲酸酯?
The molecular formula of S-(3-氯丙基)硫代氨基甲酸酯 is C4H8ClNOS.
What is the molecular weight of S-(3-氯丙基)硫代氨基甲酸酯?
The molecular weight of S-(3-氯丙基)硫代氨基甲酸酯 is 153.00 g/mol.
Where can I buy S-(3-氯丙基)硫代氨基甲酸酯?
You can request a quote for S-(3-氯丙基)硫代氨基甲酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S-(3-氯丙基)硫代氨基甲酸酯?
Yes, KEHONG BIO provides custom synthesis services for S-(3-氯丙基)硫代氨基甲酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.