N,N-Didecyldaunorubicin hydrochloride
TL;DR: N,N-Didecyldaunorubicin hydrochloride (CAS 70844-14-3) is a chemical compound with molecular formula C47H70ClNO10 and molecular weight 843.47 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-acetyl-7-[4-(didecylamino)-5-hydroxy-6-methyloxan-2-yl]oxy-6,9,11-trihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione;hydrochloride
Also Known As: N,N-Didecyldaunorubicin hydrochloride, 5,12-Naphthacenedione, 7,8,9,10-tetrahydro-8-acetyl-1-methoxy-10-((2,3,6-trideoxy-3-(didecylamino)-alpha-L-lyxo-hexopyranosyl)oxy)-6,8,11-trihydroxy-, hydrochloride, (8S-cis)-, 9-acetyl-7-[4-(didecylamino)-5-hydroxy-6-methyloxan-2-yl]oxy, 3-Acetyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-1-yl 2,3,6-trideoxy-3-(didecylamino)hexopyranoside--hydrogen chloride (1/1), 9-acetyl-7-[4-(didecylamino)-5-hydroxy-6-methyloxan-2-yl]oxy-6,9,11-trihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione hydrochloride
| Molecular Formula | C47H70ClNO10 |
|---|---|
| Molecular Weight | 843.47 g/mol |
| LogP | 9.0754 |
| Topological Polar Surface Area | 163.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 23 |
| Exact Mass | 843.4688 |
| Heavy Atoms | 59 |
| Complexity | 1280.0 |
Chemical Identifiers
| CAS Number | 70844-14-3 |
|---|---|
| SMILES | CCCCCCCCCCN(CCCCCCCCCC)C1CC(OC(C1O)C)OC2CC(CC3=C2C(=C4C(=C3O)C(=O)C5=C(C4=O)C(=CC=C5)OC)O)(C(=O)C)O.Cl |
| InChIKey | FPYYHTDGZJTMDR-UHFFFAOYSA-N |
Product Overview
N,N-Didecyldaunorubicin hydrochloride (CAS 70844-14-3), with molecular formula C47H70ClNO10 and molecular weight 843.47 g/mol. IUPAC: 9-acetyl-7-[4-(didecylamino)-5-hydroxy-6-methyloxan-2-yl]oxy-6,9,11-trihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione;hydrochloride.
Chemical Property Profile of N,N-Didecyldaunorubicin hydrochloride
Property Insights of N,N-Didecyldaunorubicin hydrochloride
The XLogP value of 9.0754 indicates that N,N-Didecyldaunorubicin hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 163.0 Ų indicates high polarity, suggesting N,N-Didecyldaunorubicin hydrochloride may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N,N-Didecyldaunorubicin hydrochloride has 5 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N,N-Didecyldaunorubicin hydrochloride?
The CAS number of N,N-Didecyldaunorubicin hydrochloride is 70844-14-3.
What is the molecular formula of N,N-Didecyldaunorubicin hydrochloride?
The molecular formula of N,N-Didecyldaunorubicin hydrochloride is C47H70ClNO10.
What is the molecular weight of N,N-Didecyldaunorubicin hydrochloride?
The molecular weight of N,N-Didecyldaunorubicin hydrochloride is 843.47 g/mol.
Where can I buy N,N-Didecyldaunorubicin hydrochloride?
You can request a quote for N,N-Didecyldaunorubicin hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-Didecyldaunorubicin hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for N,N-Didecyldaunorubicin hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.