4-(4-benzylpiperazino)-1H-indole dihydrochloride monohydrate
TL;DR: 4-(4-benzylpiperazino)-1H-indole dihydrochloride monohydrate (CAS 309755-88-2) is a chemical compound with molecular formula C19H25Cl2N3O and molecular weight 381.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-benzylpiperazin-1-yl)-1H-indole;hydrate;dihydrochloride
Also Known As: 4-(4-benzylpiperazino)-1H-indole dihydrochloride monohydrate, 4-(4-benzylpiperazin-1-yl)-1H-indole Hydrate Dihydrochloride, 4- -1H-INDOLEDIHYDROCHLORIDEMONOHYDRATE, 4-(4-Benzylpiperazin-1-yl)-1H-indole dihydrochloride hydrate, 4-(4-benzylpiperazin-1-yl)-1H-indole;hydrate;dihydrochloride
| Molecular Formula | C19H25Cl2N3O |
|---|---|
| Molecular Weight | 381.14 g/mol |
| LogP | 3.509 |
| Topological Polar Surface Area | 53.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 381.13748 |
| Heavy Atoms | 25 |
| Complexity | 755.4649 |
Chemical Identifiers
| CAS Number | 309755-88-2 |
|---|---|
| SMILES | C1CN(CCN1CC2=CC=CC=C2)C3=CC=CC4=C3C=CN4.O.Cl.Cl |
Product Overview
4-(4-benzylpiperazino)-1H-indole dihydrochloride monohydrate (CAS 309755-88-2), with molecular formula C19H25Cl2N3O and molecular weight 381.14 g/mol. IUPAC: 4-(4-benzylpiperazin-1-yl)-1H-indole;hydrate;dihydrochloride.
Chemical Property Profile of 4-(4-benzylpiperazino)-1H-indole dihydrochloride monohydrate
Property Insights of 4-(4-benzylpiperazino)-1H-indole dihydrochloride monohydrate
The XLogP value of 3.509 indicates that 4-(4-benzylpiperazino)-1H-indole dihydrochloride monohydrate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.77 Ų, 4-(4-benzylpiperazino)-1H-indole dihydrochloride monohydrate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(4-benzylpiperazino)-1H-indole dihydrochloride monohydrate has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-(4-benzylpiperazino)-1H-indole dihydrochloride monohydrate?
The CAS number of 4-(4-benzylpiperazino)-1H-indole dihydrochloride monohydrate is 309755-88-2.
What is the molecular formula of 4-(4-benzylpiperazino)-1H-indole dihydrochloride monohydrate?
The molecular formula of 4-(4-benzylpiperazino)-1H-indole dihydrochloride monohydrate is C19H25Cl2N3O.
What is the molecular weight of 4-(4-benzylpiperazino)-1H-indole dihydrochloride monohydrate?
The molecular weight of 4-(4-benzylpiperazino)-1H-indole dihydrochloride monohydrate is 381.14 g/mol.
Where can I buy 4-(4-benzylpiperazino)-1H-indole dihydrochloride monohydrate?
You can request a quote for 4-(4-benzylpiperazino)-1H-indole dihydrochloride monohydrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-benzylpiperazino)-1H-indole dihydrochloride monohydrate?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-benzylpiperazino)-1H-indole dihydrochloride monohydrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.