硫酸长春地辛
TL;DR: 硫酸长春地辛 (CAS 59917-39-4) is a chemical compound with molecular formula C43H57N5O11S and molecular weight 851.38 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
硫酸长春地辛
methyl (13S,15S,17S)-13-[(1R,9R,10S,11R,12R,19R)-10-carbamoyl-12-ethyl-10,11-dihydroxy-5-methoxy-8-methyl-8,16-diazapentacyclo[10.6.1.01,9.02,7.016,19]nonadeca-2,4,6,13-tetraen-4-yl]-17-ethyl-17-hydroxy-1,11-diazatetracyclo[13.3.1.04,12.05,10]nonadeca-4(12),5,7,9-tetraene-13-carboxylate;sulfuric acid
Also Known As: vindesine sulfate, Eldisine, Eldesine, Vindesine sulfate salt, Fildesin
| Molecular Formula | C43H57N5O11S |
|---|---|
| Molecular Weight | 851.38 g/mol |
| LogP | 2.08 |
| Topological Polar Surface Area | 248.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 7 |
| Exact Mass | 851.3775 |
| Heavy Atoms | 60 |
| Complexity | 1650.0 |
Chemical Identifiers
| CAS Number | 59917-39-4 |
|---|---|
| SMILES | CC[C@@]1(C[C@@H]2C[C@@](C3=C(CCN(C2)C1)C4=CC=CC=C4N3)(C5=C(C=C6C(=C5)[C@]78CCN9[C@H]7[C@@](C=CC9)([C@H]([C@@]([C@@H]8N6C)(C(=O)N)O)O)CC)OC)C(=O)OC)O.OS(=O)(=O)O |
| InChIKey | COFJBSXICYYSKG-FJFFLIEUSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
硫酸长春地辛 (CAS 59917-39-4), with molecular formula C43H57N5O11S and molecular weight 851.38 g/mol. IUPAC: methyl (13S,15S,17S)-13-[(1R,9R,10S,11R,12R,19R)-10-carbamoyl-12-ethyl-10,11-dihydroxy-5-methoxy-8-methyl-8,16-diazapentacyclo[10.6.1.01,9.02,7.016,19]nonadeca-2,4,6,13-tetraen-4-yl]-17-ethyl-17-hydroxy-1,11-diazatetracyclo[13.3.1.04,12.05,10]nonadeca-4(12),5,7,9-tetraene-13-carboxylate;sulfuric acid.
Chemical Property Profile of 硫酸长春地辛
Property Insights of 硫酸长春地辛
The XLogP value of 2.08 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 硫酸长春地辛. The TPSA of 248.0 Ų indicates high polarity, suggesting 硫酸长春地辛 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 硫酸长春地辛 has 7 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 硫酸长春地辛?
The CAS number of 硫酸长春地辛 is 59917-39-4.
What is the molecular formula of 硫酸长春地辛?
The molecular formula of 硫酸长春地辛 is C43H57N5O11S.
What is the molecular weight of 硫酸长春地辛?
The molecular weight of 硫酸长春地辛 is 851.38 g/mol.
Where can I buy 硫酸长春地辛?
You can request a quote for 硫酸长春地辛 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 硫酸长春地辛?
Yes, KEHONG BIO provides custom synthesis services for 硫酸长春地辛 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.