N-(3-Pyridylmethyl)adriamycin
TL;DR: N-(3-Pyridylmethyl)adriamycin (CAS 145843-38-5) is a chemical compound with molecular formula C33H34N2O11 and molecular weight 634.21625 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6,9,11-trihydroxy-9-(2-hydroxyacetyl)-7-[5-hydroxy-6-methyl-4-(pyridin-3-ylmethylamino)oxan-2-yl]oxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione
Also Known As: YM1 Doxorubicin analog, N-(3-Pyridylmethyl)adriamycin, YM3 Doxorubicin analog, N-(3-Pyridylmethyl)epidoxorubicin, YM 1
Technical Specifications
| Molecular Formula | C33H34N2O11 |
| Molecular Weight | 634.21625 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 205.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 8 |
| Exact Mass | 634.21625 Da |
| Heavy Atoms | 46 |
| Complexity | 1140.0 |
| 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)NCC6=CN=CC=C6)O |
| InChIKey | GGTVPUWEBRGMCO-UHFFFAOYSA-N |
Chemical Property Profile of N-(3-Pyridylmethyl)adriamycin
Property Insights of N-(3-Pyridylmethyl)adriamycin
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-Pyridylmethyl)adriamycin. The TPSA of 205.0 Ų indicates high polarity, suggesting N-(3-Pyridylmethyl)adriamycin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-(3-Pyridylmethyl)adriamycin has 6 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of N-(3-Pyridylmethyl)adriamycin?
The CAS number of N-(3-Pyridylmethyl)adriamycin is 145843-38-5.
What is the molecular formula of N-(3-Pyridylmethyl)adriamycin?
The molecular formula of N-(3-Pyridylmethyl)adriamycin is C33H34N2O11.
What is the molecular weight of N-(3-Pyridylmethyl)adriamycin?
The molecular weight of N-(3-Pyridylmethyl)adriamycin is 634.21625 g/mol.
Where can I buy N-(3-Pyridylmethyl)adriamycin?
You can request a quote for N-(3-Pyridylmethyl)adriamycin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(3-Pyridylmethyl)adriamycin?
Yes, CoreyChem provides custom synthesis services for N-(3-Pyridylmethyl)adriamycin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.