溶肉瘤素
TL;DR: 溶肉瘤素 (CAS 531-76-0) is a chemical compound with molecular formula C13H18Cl2N2O2 and molecular weight 304.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
溶肉瘤素
2-amino-3-[4-[bis(2-chloroethyl)amino]phenyl]propanoic acid
Also Known As: melphalan, Sarcolysin, Merphalan, Sarcolysinum, Sarcolysine
| Molecular Formula | C13H18Cl2N2O2 |
|---|---|
| Molecular Weight | 304.07 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 66.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 304.07452 |
| Heavy Atoms | 19 |
| Complexity | 265.0 |
Chemical Identifiers
| CAS Number | 531-76-0 |
|---|---|
| SMILES | C1=CC(=CC=C1CC(C(=O)O)N)N(CCCl)CCCl |
| InChIKey | SGDBTWWWUNNDEQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
溶肉瘤素 (CAS 531-76-0), with molecular formula C13H18Cl2N2O2 and molecular weight 304.07 g/mol. IUPAC: 2-amino-3-[4-[bis(2-chloroethyl)amino]phenyl]propanoic acid.
Chemical Property Profile of 溶肉瘤素
Property Insights of 溶肉瘤素
The XLogP value of -0.5 indicates that 溶肉瘤素 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 66.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 溶肉瘤素. Following Lipinski's Rule of Five, 溶肉瘤素 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 溶肉瘤素?
The CAS number of 溶肉瘤素 is 531-76-0.
What is the molecular formula of 溶肉瘤素?
The molecular formula of 溶肉瘤素 is C13H18Cl2N2O2.
What is the molecular weight of 溶肉瘤素?
The molecular weight of 溶肉瘤素 is 304.07 g/mol.
Where can I buy 溶肉瘤素?
You can request a quote for 溶肉瘤素 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 溶肉瘤素?
Yes, KEHONG BIO provides custom synthesis services for 溶肉瘤素 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.