N,N-Bis(2-chloroethyl)-N'-cyclohexyl-N''-(2-hydroxyethyl)phosphoric triamide
TL;DR: N,N-Bis(2-chloroethyl)-N'-cyclohexyl-N''-(2-hydroxyethyl)phosphoric triamide (CAS 117112-33-1) is a chemical compound with molecular formula C12H26Cl2N3O2P and molecular weight 345.11398 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[[bis(2-chloroethyl)amino-(cyclohexylamino)phosphoryl]amino]ethanol
Also Known As: N,N-Bis(2-chloroethyl)-N'-cyclohexyl-N''-(2-hydroxyethyl)phosphoric triamide, Phosphoric triamide, N,N-bis(2-chloroethyl)-N'-cyclohexyl-N''-(2-hydroxyethyl)-, 2-[[bis(2-chloroethyl)amino-(cyclohexylamino)phosphoryl]amino]ethanol
Technical Specifications
| Molecular Formula | C12H26Cl2N3O2P |
| Molecular Weight | 345.11398 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 64.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 345.11398 Da |
| Heavy Atoms | 20 |
| Complexity | 298.0 |
| SMILES | C1CCC(CC1)NP(=O)(NCCO)N(CCCl)CCCl |
| InChIKey | HGQCIGLUITYMKL-UHFFFAOYSA-N |
Chemical Property Profile of N,N-Bis(2-chloroethyl)-N'-cyclohexyl-N''-(2-hydroxyethyl)phosphoric triamide
Property Insights of N,N-Bis(2-chloroethyl)-N'-cyclohexyl-N''-(2-hydroxyethyl)phosphoric triamide
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N-Bis(2-chloroethyl)-N'-cyclohexyl-N''-(2-hydroxyethyl)phosphoric triamide. The TPSA of 64.6 Ų falls within the moderate polarity range, balancing permeability and solubility for N,N-Bis(2-chloroethyl)-N'-cyclohexyl-N''-(2-hydroxyethyl)phosphoric triamide. Following Lipinski's Rule of Five, N,N-Bis(2-chloroethyl)-N'-cyclohexyl-N''-(2-hydroxyethyl)phosphoric triamide has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N,N-Bis(2-chloroethyl)-N'-cyclohexyl-N''-(2-hydroxyethyl)phosphoric triamide?
The CAS number of N,N-Bis(2-chloroethyl)-N'-cyclohexyl-N''-(2-hydroxyethyl)phosphoric triamide is 117112-33-1.
What is the molecular formula of N,N-Bis(2-chloroethyl)-N'-cyclohexyl-N''-(2-hydroxyethyl)phosphoric triamide?
The molecular formula of N,N-Bis(2-chloroethyl)-N'-cyclohexyl-N''-(2-hydroxyethyl)phosphoric triamide is C12H26Cl2N3O2P.
What is the molecular weight of N,N-Bis(2-chloroethyl)-N'-cyclohexyl-N''-(2-hydroxyethyl)phosphoric triamide?
The molecular weight of N,N-Bis(2-chloroethyl)-N'-cyclohexyl-N''-(2-hydroxyethyl)phosphoric triamide is 345.11398 g/mol.
Where can I buy N,N-Bis(2-chloroethyl)-N'-cyclohexyl-N''-(2-hydroxyethyl)phosphoric triamide?
You can request a quote for N,N-Bis(2-chloroethyl)-N'-cyclohexyl-N''-(2-hydroxyethyl)phosphoric triamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N,N-Bis(2-chloroethyl)-N'-cyclohexyl-N''-(2-hydroxyethyl)phosphoric triamide?
Yes, CoreyChem provides custom synthesis services for N,N-Bis(2-chloroethyl)-N'-cyclohexyl-N''-(2-hydroxyethyl)phosphoric triamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.