Mdl 27695
TL;DR: Mdl 27695 (CAS 117654-71-4) is a chemical compound with molecular formula C27H44N4 and molecular weight 424.3566 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N,N'-bis[3-(benzylamino)propyl]heptane-1,7-diamine
Also Known As: Mdl 27695, KST-1B0040, 1,7-Heptanediamine, N,N'-bis(3-((phenylmethyl)amino)propyl)-, N,N'-bis[3-(benzylamino)propyl]heptane-1,7-diamine, N,N'-Bis(3-((phenylmethyl)amino)propyl)-1,7-diaminoheptane
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C27H44N4 |
| Molecular Weight | 424.3566 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 48.1 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 20 |
| Exact Mass | 424.3566 Da |
| Heavy Atoms | 31 |
| Complexity | 330.0 |
| SMILES | C1=CC=C(C=C1)CNCCCNCCCCCCCNCCCNCC2=CC=CC=C2 |
| InChIKey | HZKTVSPJAMOCGF-UHFFFAOYSA-N |
Chemical Property Profile of Mdl 27695
Property Insights of Mdl 27695
The XLogP value of 4.2 indicates that Mdl 27695 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.1 Ų, Mdl 27695 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Mdl 27695 has 4 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Mdl 27695?
The CAS number of Mdl 27695 is 117654-71-4.
What is the molecular formula of Mdl 27695?
The molecular formula of Mdl 27695 is C27H44N4.
What is the molecular weight of Mdl 27695?
The molecular weight of Mdl 27695 is 424.3566 g/mol.
Where can I buy Mdl 27695?
You can request a quote for Mdl 27695 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Mdl 27695?
Yes, CoreyChem provides custom synthesis services for Mdl 27695 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.