N-Formyladriamycin
TL;DR: N-Formyladriamycin (CAS 76573-10-9) is a chemical compound with molecular formula C28H29NO12 and molecular weight 571.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-hydroxy-2-methyl-6-[[(1S,3S)-3,5,12-trihydroxy-3-(2-hydroxyacetyl)-10-methoxy-6,11-dioxo-2,4-dihydro-1H-tetracen-1-yl]oxy]oxan-4-yl]formamide
Also Known As: N-Formyladriamycin, N-[3-hydroxy-2-methyl-6-[[(1S,3S)-3,5,12-trihydroxy-3-(2-hydroxyacetyl)-10-methoxy-6,11-dioxo-2,4-dihydro-1H-tetracen-1-yl]oxy]oxan-4-yl]formamide, (1S,3S)-3,5,12-Trihydroxy-3-(hydroxyacetyl)-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-1-yl 2,3,6-trideoxy-3-formamidohexopyranoside, 5, 7,8,9,10-tetrahydro-6,8,11-trihydroxy-8-(hydroxyacetyl)-1-methoxy-10-[[2,3,6-trideoxy-3-(formylamino)-.alpha.-L-lyxo-hexopyranosyl]oxy]-, (8S-cis)-, 5,12-Naphthacenedione, 7,8,9,10-tetrahydro-6,8,11-trihydroxy-8-(hydroxyacetyl)-1-methoxy-10-[[2,3,6-trideoxy-3-(formylamino)-.alpha.-L-lyxo-hexopyranosyl]oxy]-, (8S-cis)-
| Molecular Formula | C28H29NO12 |
|---|---|
| Molecular Weight | 571.17 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 209.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 6 |
| Exact Mass | 571.16895 |
| Heavy Atoms | 41 |
| Complexity | 1040.0 |
Chemical Identifiers
| CAS Number | 76573-10-9 |
|---|---|
| SMILES | CC1C(C(CC(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)NC=O)O |
| InChIKey | HDZSJJZLQYFKQG-PHKCKUDBSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-Formyladriamycin (CAS 76573-10-9), with molecular formula C28H29NO12 and molecular weight 571.17 g/mol. IUPAC: N-[3-hydroxy-2-methyl-6-[[(1S,3S)-3,5,12-trihydroxy-3-(2-hydroxyacetyl)-10-methoxy-6,11-dioxo-2,4-dihydro-1H-tetracen-1-yl]oxy]oxan-4-yl]formamide.
Chemical Property Profile of N-Formyladriamycin
Property Insights of N-Formyladriamycin
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Formyladriamycin. The TPSA of 209.0 Ų indicates high polarity, suggesting N-Formyladriamycin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-Formyladriamycin has 6 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-Formyladriamycin?
The CAS number of N-Formyladriamycin is 76573-10-9.
What is the molecular formula of N-Formyladriamycin?
The molecular formula of N-Formyladriamycin is C28H29NO12.
What is the molecular weight of N-Formyladriamycin?
The molecular weight of N-Formyladriamycin is 571.17 g/mol.
Where can I buy N-Formyladriamycin?
You can request a quote for N-Formyladriamycin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Formyladriamycin?
Yes, KEHONG BIO provides custom synthesis services for N-Formyladriamycin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.