Tallimustine
TL;DR: Tallimustine (CAS 115308-98-0) is a chemical compound with molecular formula C32H38Cl2N10O4 and molecular weight 696.2455 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[5-[[5-[(3-amino-3-iminopropyl)carbamoyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]-4-[[4-[bis(2-chloroethyl)amino]benzoyl]amino]-1-methylpyrrole-2-carboxamide
Also Known As: Tallimustine, talimustina, Tallimustine [INN], tallimustinum, Talimustine
Application Areas
Top 5 of 9 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C32H38Cl2N10O4 |
| Molecular Weight | 696.2455 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 184.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 15 |
| Exact Mass | 696.2455 Da |
| Heavy Atoms | 48 |
| Complexity | 1140.0 |
| SMILES | CN1C=C(C=C1C(=O)NC2=CN(C(=C2)C(=O)NC3=CN(C(=C3)C(=O)NCCC(=N)N)C)C)NC(=O)C4=CC=C(C=C4)N(CCCl)CCCl |
| InChIKey | ARKYUICTMUZVEW-UHFFFAOYSA-N |
Chemical Property Profile of Tallimustine
Property Insights of Tallimustine
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Tallimustine. The TPSA of 184.0 Ų indicates high polarity, suggesting Tallimustine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Tallimustine has 6 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Tallimustine?
The CAS number of Tallimustine is 115308-98-0.
What is the molecular formula of Tallimustine?
The molecular formula of Tallimustine is C32H38Cl2N10O4.
What is the molecular weight of Tallimustine?
The molecular weight of Tallimustine is 696.2455 g/mol.
Where can I buy Tallimustine?
You can request a quote for Tallimustine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Tallimustine?
Yes, CoreyChem provides custom synthesis services for Tallimustine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.