替洛蒽醌盐酸盐(无水物)
TL;DR: 替洛蒽醌盐酸盐(无水物) (CAS 123830-79-5) is a chemical compound with molecular formula C21H27Cl2N5O4 and molecular weight 483.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
替洛蒽醌盐酸盐(无水物)
6,8-dihydroxy-14-[2-(2-hydroxyethylamino)ethyl]-10-[2-(methylamino)ethylimino]-14,15-diazatetracyclo[7.6.1.02,7.013,16]hexadeca-1,4,6,8,11,13(16)-hexaen-3-one;dihydrochloride
Also Known As: Teloxantrone hydrochloride, Teloxantrone HCl, DUP 937, Teloxantrone hydrochloride anhydrous, 6,8-dihydroxy-14-[2-(2-hydroxyethylamino)ethyl]-10-[2-(methylamino)ethylimino]-14,15-diazatetracyclo[7.6.1.02,7.013,16]hexadeca-1,4,6,8,11,13(16)-hexaen-3-one;dihydrochloride
| Molecular Formula | C21H27Cl2N5O4 |
|---|---|
| Molecular Weight | 483.14 g/mol |
| LogP | 1.0306 |
| Topological Polar Surface Area | 129.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 483.144 |
| Heavy Atoms | 32 |
| Complexity | 997.0 |
Chemical Identifiers
| CAS Number | 123830-79-5 |
|---|---|
| SMILES | CNCCN=C1C=CC2=C3C1=C(C4=C(C=CC(=O)C4=C3NN2CCNCCO)O)O.Cl.Cl |
| InChIKey | YPKURCRDOQMMLW-UHFFFAOYSA-N |
Product Overview
替洛蒽醌盐酸盐(无水物) (CAS 123830-79-5), with molecular formula C21H27Cl2N5O4 and molecular weight 483.14 g/mol. IUPAC: 6,8-dihydroxy-14-[2-(2-hydroxyethylamino)ethyl]-10-[2-(methylamino)ethylimino]-14,15-diazatetracyclo[7.6.1.02,7.013,16]hexadeca-1,4,6,8,11,13(16)-hexaen-3-one;dihydrochloride.
Chemical Property Profile of 替洛蒽醌盐酸盐(无水物)
Property Insights of 替洛蒽醌盐酸盐(无水物)
The XLogP value of 1.0306 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 替洛蒽醌盐酸盐(无水物). The TPSA of 129.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 替洛蒽醌盐酸盐(无水物). Following Lipinski's Rule of Five, 替洛蒽醌盐酸盐(无水物) has 8 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 替洛蒽醌盐酸盐(无水物)?
The CAS number of 替洛蒽醌盐酸盐(无水物) is 123830-79-5.
What is the molecular formula of 替洛蒽醌盐酸盐(无水物)?
The molecular formula of 替洛蒽醌盐酸盐(无水物) is C21H27Cl2N5O4.
What is the molecular weight of 替洛蒽醌盐酸盐(无水物)?
The molecular weight of 替洛蒽醌盐酸盐(无水物) is 483.14 g/mol.
Where can I buy 替洛蒽醌盐酸盐(无水物)?
You can request a quote for 替洛蒽醌盐酸盐(无水物) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 替洛蒽醌盐酸盐(无水物)?
Yes, KEHONG BIO provides custom synthesis services for 替洛蒽醌盐酸盐(无水物) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.