硫酸长春唑啶
TL;DR: 硫酸长春唑啶 (CAS 67699-41-6) is a chemical compound with molecular formula C48H60ClN5O13S and molecular weight 981.36 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
硫酸长春唑啶
methyl (13S,15R,17S)-13-[(1'R,5S,9'R,11'R,12'R,19'R)-11'-acetyloxy-3-(2-chloroethyl)-12'-ethyl-5'-methoxy-8'-methyl-2,4-dioxospiro[1,3-oxazolidine-5,10'-8,16-diazapentacyclo[10.6.1.01,9.02,7.016,19]nonadeca-2,4,6,13-tetraene]-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: VINZOLIDINE SULFATE, Vinzolidine sulphate, Vinzolidine sulfate [USAN], Vinzolidine sulfate (USAN), LY 104208
| Molecular Formula | C48H60ClN5O13S |
|---|---|
| Molecular Weight | 981.36 g/mol |
| LogP | 4.3904 |
| Topological Polar Surface Area | 228.78 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 8 |
| Exact Mass | 981.3597 |
| Heavy Atoms | 68 |
| Complexity | 2708.4631 |
Chemical Identifiers
| CAS Number | 67699-41-6 |
|---|---|
| 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@@]1([C@@H]8N6C)C(=O)N(C(=O)O1)CCCl)OC(=O)C)CC)OC)C(=O)OC)O.OS(=O)(=O)O |
Product Overview
硫酸长春唑啶 (CAS 67699-41-6), with molecular formula C48H60ClN5O13S and molecular weight 981.36 g/mol. IUPAC: methyl (13S,15R,17S)-13-[(1'R,5S,9'R,11'R,12'R,19'R)-11'-acetyloxy-3-(2-chloroethyl)-12'-ethyl-5'-methoxy-8'-methyl-2,4-dioxospiro[1,3-oxazolidine-5,10'-8,16-diazapentacyclo[10.6.1.01,9.02,7.016,19]nonadeca-2,4,6,13-tetraene]-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 硫酸长春唑啶
Property Insights of 硫酸长春唑啶
The XLogP value of 4.3904 indicates that 硫酸长春唑啶 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 228.78 Ų indicates high polarity, suggesting 硫酸长春唑啶 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 硫酸长春唑啶 has 4 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 硫酸长春唑啶?
The CAS number of 硫酸长春唑啶 is 67699-41-6.
What is the molecular formula of 硫酸长春唑啶?
The molecular formula of 硫酸长春唑啶 is C48H60ClN5O13S.
What is the molecular weight of 硫酸长春唑啶?
The molecular weight of 硫酸长春唑啶 is 981.36 g/mol.
Where can I buy 硫酸长春唑啶?
You can request a quote for 硫酸长春唑啶 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 硫酸长春唑啶?
Yes, KEHONG BIO provides custom synthesis services for 硫酸长春唑啶 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.