Nefazodone Hydrochloride
TL;DR: Nefazodone Hydrochloride (CAS 82752-99-6) is a chemical compound with molecular formula C25H33Cl2N5O2 and molecular weight 505.20114 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[3-[4-(3-chlorophenyl)piperazin-1-yl]propyl]-5-ethyl-4-(2-phenoxyethyl)-1,2,4-triazol-3-one;hydrochloride
Also Known As: NEFAZODONE HYDROCHLORIDE, Nefazodone Hcl, Dutonin, Serzone, nefazodone
Application Areas
Top 5 of 13 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C25H33Cl2N5O2 |
| Molecular Weight | 505.20114 g/mol |
| XLogP | 3.97 |
| Topological Polar Surface Area (TPSA) | 51.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 505.20114 Da |
| Heavy Atoms | 34 |
| Complexity | 649.0 |
| SMILES | CCC1=NN(C(=O)N1CCOC2=CC=CC=C2)CCCN3CCN(CC3)C4=CC(=CC=C4)Cl.Cl |
| InChIKey | DYCKFEBIOUQECE-UHFFFAOYSA-N |
Chemical Property Profile of Nefazodone Hydrochloride
Property Insights of Nefazodone Hydrochloride
The XLogP value of 3.97 indicates that Nefazodone Hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.6 Ų, Nefazodone Hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Nefazodone Hydrochloride has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Nefazodone Hydrochloride?
The CAS number of Nefazodone Hydrochloride is 82752-99-6.
What is the molecular formula of Nefazodone Hydrochloride?
The molecular formula of Nefazodone Hydrochloride is C25H33Cl2N5O2.
What is the molecular weight of Nefazodone Hydrochloride?
The molecular weight of Nefazodone Hydrochloride is 505.20114 g/mol.
Where can I buy Nefazodone Hydrochloride?
You can request a quote for Nefazodone Hydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Nefazodone Hydrochloride?
Yes, CoreyChem provides custom synthesis services for Nefazodone Hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.