cis-(Ptcl2(Dx)(tba))
TL;DR: cis-(Ptcl2(Dx)(tba)) (CAS 117685-73-1) is a chemical compound with molecular formula C31H40Cl2N2O11Pt and molecular weight 881.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(4-amino-5-hydroxy-6-methyloxan-2-yl)oxy-6,9,11-trihydroxy-9-(2-hydroxyacetyl)-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione;2-methylpropan-2-amine;platinum(2+);dichloride
Also Known As: cis-(Ptcl2(Dx)(tba)), cis-(Platinum-dichloro(doxorubicin)(tert-butylamine)), 7-(4-amino-5-hydroxy-6-methyl-tetrahydropyran-2-yl)oxy-6,9,11-trihydroxy-9-(2-hydroxyacetyl)-4-methoxy-8,10-dihydro-7h-tetracene-5,12-dione; 2-methylpropan-2-amine; platinum(+2) cation; dichloride, 7-(4-amino-5-hydroxy-6-methyloxan-2-yl)oxy-6,9,11-trihydroxy-9-(2-hydroxyacetyl)-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione; 2-methylpropan-2-amine; platinum(2+); dichloride
| Molecular Formula | C31H40Cl2N2O11Pt |
|---|---|
| Molecular Weight | 881.17 g/mol |
| LogP | -5.2496 |
| Topological Polar Surface Area | 232.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 5 |
| Exact Mass | 881.1657 |
| Heavy Atoms | 47 |
| Complexity | 1000.0 |
Chemical Identifiers
| CAS Number | 117685-73-1 |
|---|---|
| SMILES | CC1C(C(CC(O1)OC2CC(CC3=C2C(=C4C(=C3O)C(=O)C5=C(C4=O)C(=CC=C5)OC)O)(C(=O)CO)O)N)O.CC(C)(C)N.[Cl-].[Cl-].[Pt+2] |
| InChIKey | GNAWGIDWYXHXEH-UHFFFAOYSA-L |
Product Overview
cis-(Ptcl2(Dx)(tba)) (CAS 117685-73-1), with molecular formula C31H40Cl2N2O11Pt and molecular weight 881.17 g/mol. IUPAC: 7-(4-amino-5-hydroxy-6-methyloxan-2-yl)oxy-6,9,11-trihydroxy-9-(2-hydroxyacetyl)-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione;2-methylpropan-2-amine;platinum(2+);dichloride.
Chemical Property Profile of cis-(Ptcl2(Dx)(tba))
Property Insights of cis-(Ptcl2(Dx)(tba))
The XLogP value of -5.2496 indicates that cis-(Ptcl2(Dx)(tba)) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 232.0 Ų indicates high polarity, suggesting cis-(Ptcl2(Dx)(tba)) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, cis-(Ptcl2(Dx)(tba)) has 7 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of cis-(Ptcl2(Dx)(tba))?
The CAS number of cis-(Ptcl2(Dx)(tba)) is 117685-73-1.
What is the molecular formula of cis-(Ptcl2(Dx)(tba))?
The molecular formula of cis-(Ptcl2(Dx)(tba)) is C31H40Cl2N2O11Pt.
What is the molecular weight of cis-(Ptcl2(Dx)(tba))?
The molecular weight of cis-(Ptcl2(Dx)(tba)) is 881.17 g/mol.
Where can I buy cis-(Ptcl2(Dx)(tba))?
You can request a quote for cis-(Ptcl2(Dx)(tba)) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for cis-(Ptcl2(Dx)(tba))?
Yes, KEHONG BIO provides custom synthesis services for cis-(Ptcl2(Dx)(tba)) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.