4'-Amino-3'-hydroxydoxorubicin
TL;DR: 4'-Amino-3'-hydroxydoxorubicin (CAS 116610-70-9) is a chemical compound with molecular formula C27H29NO11 and molecular weight 543.1741 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(7S,9S)-7-[(2R,4S,5S,6S)-5-amino-4-hydroxy-6-methyloxan-2-yl]oxy-6,9,11-trihydroxy-9-(2-hydroxyacetyl)-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione
Also Known As: Vintoperol, 4'-Amino-3'-hydroxydoxorubicin, 4'-Amino-3'-hydroxy-doxorubicin, 3 -Deamino-3 -hydroxy-4 -aminoadriamycin, (7S,9S)-7-[(2R,4S,5S,6S)-5-amino-4-hydroxy-6-methyloxan-2-yl]oxy-6,9,11-trihydroxy-9-(2-hydroxyacetyl)-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione
Technical Specifications
| Molecular Formula | C27H29NO11 |
| Molecular Weight | 543.1741 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 206.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 5 |
| Exact Mass | 543.1741 Da |
| Heavy Atoms | 39 |
| Complexity | 977.0 |
| SMILES | C[C@H]1[C@H]([C@H](C[C@@H](O1)O[C@H]2C[C@@](CC3=C2C(=C4C(=C3O)C(=O)C5=C(C4=O)C(=CC=C5)OC)O)(C(=O)CO)O)O)N |
| InChIKey | DPWXJJCAARDEAI-TZSSRYMLSA-N |
Chemical Property Profile of 4'-Amino-3'-hydroxydoxorubicin
Property Insights of 4'-Amino-3'-hydroxydoxorubicin
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4'-Amino-3'-hydroxydoxorubicin. The TPSA of 206.0 Ų indicates high polarity, suggesting 4'-Amino-3'-hydroxydoxorubicin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4'-Amino-3'-hydroxydoxorubicin has 6 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 4'-Amino-3'-hydroxydoxorubicin?
The CAS number of 4'-Amino-3'-hydroxydoxorubicin is 116610-70-9.
What is the molecular formula of 4'-Amino-3'-hydroxydoxorubicin?
The molecular formula of 4'-Amino-3'-hydroxydoxorubicin is C27H29NO11.
What is the molecular weight of 4'-Amino-3'-hydroxydoxorubicin?
The molecular weight of 4'-Amino-3'-hydroxydoxorubicin is 543.1741 g/mol.
Where can I buy 4'-Amino-3'-hydroxydoxorubicin?
You can request a quote for 4'-Amino-3'-hydroxydoxorubicin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4'-Amino-3'-hydroxydoxorubicin?
Yes, CoreyChem provides custom synthesis services for 4'-Amino-3'-hydroxydoxorubicin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.