卡泊芬净
TL;DR: 卡泊芬净 (CAS 24386-89-8) is a chemical compound with molecular formula C52H88N10O15 and molecular weight 1092.64 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
卡泊芬净
N-[(3S,6S,9S,11R,15S,18S,20R,21S,24S,25S)-21-(2-aminoethylamino)-3-[(1R)-3-amino-1-hydroxypropyl]-6-[(1S,2S)-1,2-dihydroxy-2-(4-hydroxyphenyl)ethyl]-11,20,25-trihydroxy-15-[(1R)-1-hydroxyethyl]-2,5,8,14,17,23-hexaoxo-1,4,7,13,16,22-hexazatricyclo[22.3.0.09,13]heptacosan-18-yl]-10,12-dimethyltetradecanamide
Also Known As: Caspofungin, Cancidas, Caspofungin acetate, Capsofungin, Cancidas (TN)
| Molecular Formula | C52H88N10O15 |
|---|---|
| Molecular Weight | 1092.64 g/mol |
| LogP | -3.3119 |
| Topological Polar Surface Area | 412.03 Ų |
| Hydrogen Bond Donors | 16 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 23 |
| Exact Mass | 1092.6431 |
| Heavy Atoms | 77 |
| Complexity | 2074.3496 |
Chemical Identifiers
| CAS Number | 24386-89-8 |
|---|---|
| SMILES | CCC(C)CC(C)CCCCCCCCC(=O)N[C@H]1C[C@H]([C@H](NC(=O)[C@@H]2[C@H](CCN2C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]3C[C@H](CN3C(=O)[C@@H](NC1=O)[C@@H](C)O)O)[C@@H]([C@H](C4=CC=C(C=C4)O)O)O)[C@@H](CCN)O)O)NCCN)O |
Product Overview
卡泊芬净 (CAS 24386-89-8), with molecular formula C52H88N10O15 and molecular weight 1092.64 g/mol. IUPAC: N-[(3S,6S,9S,11R,15S,18S,20R,21S,24S,25S)-21-(2-aminoethylamino)-3-[(1R)-3-amino-1-hydroxypropyl]-6-[(1S,2S)-1,2-dihydroxy-2-(4-hydroxyphenyl)ethyl]-11,20,25-trihydroxy-15-[(1R)-1-hydroxyethyl]-2,5,8,14,17,23-hexaoxo-1,4,7,13,16,22-hexazatricyclo[22.3.0.09,13]heptacosan-18-yl]-10,12-dimethyltetradecanamide.
Chemical Property Profile of 卡泊芬净
Property Insights of 卡泊芬净
The XLogP value of -3.3119 indicates that 卡泊芬净 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 412.03 Ų indicates high polarity, suggesting 卡泊芬净 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 卡泊芬净 has 16 hydrogen bond donor(s) and 18 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 卡泊芬净?
The CAS number of 卡泊芬净 is 24386-89-8.
What is the molecular formula of 卡泊芬净?
The molecular formula of 卡泊芬净 is C52H88N10O15.
What is the molecular weight of 卡泊芬净?
The molecular weight of 卡泊芬净 is 1092.64 g/mol.
Where can I buy 卡泊芬净?
You can request a quote for 卡泊芬净 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 卡泊芬净?
Yes, KEHONG BIO provides custom synthesis services for 卡泊芬净 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.