C25H25ClINO3
TL;DR: C25H25ClINO3 (CAS 1037798-81-4) is a chemical compound with molecular formula C25H25ClINO3 and molecular weight 549.05676 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
tert-butyl N-[(E)-3-chloroprop-2-enyl]-N-(1-iodo-4-phenylmethoxynaphthalen-2-yl)carbamate
Also Known As: (E)-tert-Butyl (4-(benzyloxy)-1-iodonaphthalen-2-yl)(3-chloroallyl)carbamate, Tert-butyl N-[(E)-3-chloroprop-2-enyl]-N-(1-iodo-4-phenylmethoxy-naphthalen-2-yl)carbamate
Technical Specifications
| Molecular Formula | C25H25ClINO3 |
| Molecular Weight | 549.05676 g/mol |
| XLogP | 7.0 |
| Topological Polar Surface Area (TPSA) | 38.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 549.05676 Da |
| Heavy Atoms | 31 |
| Complexity | 602.0 |
| SMILES | CC(C)(C)OC(=O)N(C/C=C/Cl)C1=C(C2=CC=CC=C2C(=C1)OCC3=CC=CC=C3)I |
| InChIKey | XMJUMEZIWUDVIO-NTEUORMPSA-N |
Chemical Property Profile of C25H25ClINO3
Property Insights of C25H25ClINO3
The XLogP value of 7.0 indicates that C25H25ClINO3 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.8 Ų, C25H25ClINO3 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C25H25ClINO3 has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of C25H25ClINO3?
The CAS number of C25H25ClINO3 is 1037798-81-4.
What is the molecular formula of C25H25ClINO3?
The molecular formula of C25H25ClINO3 is C25H25ClINO3.
What is the molecular weight of C25H25ClINO3?
The molecular weight of C25H25ClINO3 is 549.05676 g/mol.
Where can I buy C25H25ClINO3?
You can request a quote for C25H25ClINO3 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for C25H25ClINO3?
Yes, CoreyChem provides custom synthesis services for C25H25ClINO3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.