苯并噻吩-2-甲酸-赖氨酸
TL;DR: 苯并噻吩-2-甲酸-赖氨酸 (CAS 119979-98-5) is a chemical compound with molecular formula C15H20N2O4S and molecular weight 324.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
苯并噻吩-2-甲酸-赖氨酸
1-benzothiophene-2-carboxylic acid;(2S)-2,6-diaminohexanoic acid
Also Known As: TNLY, Thionapthene-2-carboxylic acid-lysine, Thionapthene-2-carboxylic acid lysine salt, Benzimidazole-7-Carboxylic Acid Hydrazide, L-Lysine, monobenzo(b)thiophene-2-carboxylate
| Molecular Formula | C15H20N2O4S |
|---|---|
| Molecular Weight | 324.11 g/mol |
| LogP | 2.1268 |
| Topological Polar Surface Area | 155.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 324.11438 |
| Heavy Atoms | 22 |
| Complexity | 299.0 |
Chemical Identifiers
| CAS Number | 119979-98-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=C(S2)C(=O)O.C(CCN)C[C@@H](C(=O)O)N |
| InChIKey | OIRWVCFHDZVOIC-ZSCHJXSPSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
苯并噻吩-2-甲酸-赖氨酸 (CAS 119979-98-5), with molecular formula C15H20N2O4S and molecular weight 324.11 g/mol. IUPAC: 1-benzothiophene-2-carboxylic acid;(2S)-2,6-diaminohexanoic acid.
Chemical Property Profile of 苯并噻吩-2-甲酸-赖氨酸
Property Insights of 苯并噻吩-2-甲酸-赖氨酸
The XLogP value of 2.1268 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 苯并噻吩-2-甲酸-赖氨酸. The TPSA of 155.0 Ų indicates high polarity, suggesting 苯并噻吩-2-甲酸-赖氨酸 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 苯并噻吩-2-甲酸-赖氨酸 has 4 hydrogen bond donor(s) and 7 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 苯并噻吩-2-甲酸-赖氨酸?
The CAS number of 苯并噻吩-2-甲酸-赖氨酸 is 119979-98-5.
What is the molecular formula of 苯并噻吩-2-甲酸-赖氨酸?
The molecular formula of 苯并噻吩-2-甲酸-赖氨酸 is C15H20N2O4S.
What is the molecular weight of 苯并噻吩-2-甲酸-赖氨酸?
The molecular weight of 苯并噻吩-2-甲酸-赖氨酸 is 324.11 g/mol.
Where can I buy 苯并噻吩-2-甲酸-赖氨酸?
You can request a quote for 苯并噻吩-2-甲酸-赖氨酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 苯并噻吩-2-甲酸-赖氨酸?
Yes, KEHONG BIO provides custom synthesis services for 苯并噻吩-2-甲酸-赖氨酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.