![2-氨基-3-[(苯甲基)硫代]丁酸 structure](/static/products/637/63701-11-1.png)
2-氨基-3-[(苯甲基)硫代]丁酸
TL;DR: 2-氨基-3-[(苯甲基)硫代]丁酸 (CAS 63701-11-1) is a chemical compound with molecular formula C11H15NO2S and molecular weight 225.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-氨基-3-[(苯甲基)硫代]丁酸
2-amino-3-benzylsulfanylbutanoic acid
Also Known As: 2-amino-3-benzylsulfanylbutanoic acid, Butanoic acid, 2-amino-3-[(phenylmethyl)thio]-, (2R,3S)-2-Amino-3-(benzylthio)butanoicacid, (2R,3S)-2-amino-3-benzylsulfanylbutanoic acid, (2S,3R)-2-amino-3-benzylsulfanylbutanoic acid
| Molecular Formula | C11H15NO2S |
|---|---|
| Molecular Weight | 225.08 g/mol |
| LogP | -0.8 |
| Topological Polar Surface Area | 88.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 225.08235 |
| Heavy Atoms | 15 |
| Complexity | 205.0 |
Chemical Identifiers
| CAS Number | 63701-11-1 |
|---|---|
| SMILES | CC(C(C(=O)O)N)SCC1=CC=CC=C1 |
| InChIKey | LFDBFDNFEXIDJQ-UHFFFAOYSA-N |
Product Overview
2-氨基-3-[(苯甲基)硫代]丁酸 (CAS 63701-11-1), with molecular formula C11H15NO2S and molecular weight 225.08 g/mol. IUPAC: 2-amino-3-benzylsulfanylbutanoic acid.
Chemical Property Profile of 2-氨基-3-[(苯甲基)硫代]丁酸
Property Insights of 2-氨基-3-[(苯甲基)硫代]丁酸
The XLogP value of -0.8 indicates that 2-氨基-3-[(苯甲基)硫代]丁酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 88.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-氨基-3-[(苯甲基)硫代]丁酸. Following Lipinski's Rule of Five, 2-氨基-3-[(苯甲基)硫代]丁酸 has 2 hydrogen bond donor(s) and 4 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 2-氨基-3-[(苯甲基)硫代]丁酸?
The CAS number of 2-氨基-3-[(苯甲基)硫代]丁酸 is 63701-11-1.
What is the molecular formula of 2-氨基-3-[(苯甲基)硫代]丁酸?
The molecular formula of 2-氨基-3-[(苯甲基)硫代]丁酸 is C11H15NO2S.
What is the molecular weight of 2-氨基-3-[(苯甲基)硫代]丁酸?
The molecular weight of 2-氨基-3-[(苯甲基)硫代]丁酸 is 225.08 g/mol.
Where can I buy 2-氨基-3-[(苯甲基)硫代]丁酸?
You can request a quote for 2-氨基-3-[(苯甲基)硫代]丁酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-氨基-3-[(苯甲基)硫代]丁酸?
Yes, KEHONG BIO provides custom synthesis services for 2-氨基-3-[(苯甲基)硫代]丁酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.