1-Piperazineethanamine, N-(2,6-dimethyl-3-nitro-4-pyridinyl)-4-(diphenylmethyl)-N-methyl-, hydrochloride, hydrate (1:3:1)
TL;DR: 1-Piperazineethanamine, N-(2,6-dimethyl-3-nitro-4-pyridinyl)-4-(diphenylmethyl)-N-methyl-, hydrochloride, hydrate (1:3:1) (CAS 110629-35-1) is a chemical compound with molecular formula C27H36Cl3N5O2 and molecular weight 567.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(4-benzhydrylpiperazin-1-yl)ethyl]-N,4,6-trimethyl-5-nitropyridin-2-amine;trihydrochloride
Also Known As: 1-Piperazineethanamine, N-(2,6-dimethyl-3-nitro-4-pyridinyl)-4-(diphenylmethyl)-N-methyl-, hydrochloride, hydrate (1:3:1), N-[2-(4-benzhydrylpiperazin-1-yl)ethyl]-N,4,6-trimethyl-5-nitro-pyridin-2-amine Trihydrochloride, N-[2-(4-benzhydrylpiperazin-1-yl)ethyl]-N,4,6-trimethyl-5-nitropyridin-2-amine trihydrochloride, N-{2-[4-(Diphenylmethyl)piperazin-1-yl]ethyl}-N,4,6-trimethyl-5-nitropyridin-2-amine--hydrogen chloride (1/3), RefChem:233669
| Molecular Formula | C27H36Cl3N5O2 |
|---|---|
| Molecular Weight | 567.19 g/mol |
| LogP | 5.71544 |
| Topological Polar Surface Area | 65.75 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 567.1935 |
| Heavy Atoms | 37 |
| Complexity | 1051.0343 |
Chemical Identifiers
| CAS Number | 110629-35-1 |
|---|---|
| SMILES | CC1=CC(=NC(=C1[N+](=O)[O-])C)N(C)CCN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4.Cl.Cl.Cl |
Product Overview
1-Piperazineethanamine, N-(2,6-dimethyl-3-nitro-4-pyridinyl)-4-(diphenylmethyl)-N-methyl-, hydrochloride, hydrate (1:3:1) (CAS 110629-35-1), with molecular formula C27H36Cl3N5O2 and molecular weight 567.19 g/mol. IUPAC: N-[2-(4-benzhydrylpiperazin-1-yl)ethyl]-N,4,6-trimethyl-5-nitropyridin-2-amine;trihydrochloride.
Chemical Property Profile of 1-Piperazineethanamine, N-(2,6-dimethyl-3-nitro-4-pyridinyl)-4-(diphenylmethyl)-N-methyl-, hydrochloride, hydrate (1:3:1)
Property Insights of 1-Piperazineethanamine, N-(2,6-dimethyl-3-nitro-4-pyridinyl)-4-(diphenylmethyl)-N-methyl-, hydrochloride, hydrate (1:3:1)
The XLogP value of 5.71544 indicates that 1-Piperazineethanamine, N-(2,6-dimethyl-3-nitro-4-pyridinyl)-4-(diphenylmethyl)-N-methyl-, hydrochloride, hydrate (1:3:1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.75 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Piperazineethanamine, N-(2,6-dimethyl-3-nitro-4-pyridinyl)-4-(diphenylmethyl)-N-methyl-, hydrochloride, hydrate (1:3:1). Following Lipinski's Rule of Five, 1-Piperazineethanamine, N-(2,6-dimethyl-3-nitro-4-pyridinyl)-4-(diphenylmethyl)-N-methyl-, hydrochloride, hydrate (1:3:1) has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Piperazineethanamine, N-(2,6-dimethyl-3-nitro-4-pyridinyl)-4-(diphenylmethyl)-N-methyl-, hydrochloride, hydrate (1:3:1)?
The CAS number of 1-Piperazineethanamine, N-(2,6-dimethyl-3-nitro-4-pyridinyl)-4-(diphenylmethyl)-N-methyl-, hydrochloride, hydrate (1:3:1) is 110629-35-1.
What is the molecular formula of 1-Piperazineethanamine, N-(2,6-dimethyl-3-nitro-4-pyridinyl)-4-(diphenylmethyl)-N-methyl-, hydrochloride, hydrate (1:3:1)?
The molecular formula of 1-Piperazineethanamine, N-(2,6-dimethyl-3-nitro-4-pyridinyl)-4-(diphenylmethyl)-N-methyl-, hydrochloride, hydrate (1:3:1) is C27H36Cl3N5O2.
What is the molecular weight of 1-Piperazineethanamine, N-(2,6-dimethyl-3-nitro-4-pyridinyl)-4-(diphenylmethyl)-N-methyl-, hydrochloride, hydrate (1:3:1)?
The molecular weight of 1-Piperazineethanamine, N-(2,6-dimethyl-3-nitro-4-pyridinyl)-4-(diphenylmethyl)-N-methyl-, hydrochloride, hydrate (1:3:1) is 567.19 g/mol.
Where can I buy 1-Piperazineethanamine, N-(2,6-dimethyl-3-nitro-4-pyridinyl)-4-(diphenylmethyl)-N-methyl-, hydrochloride, hydrate (1:3:1)?
You can request a quote for 1-Piperazineethanamine, N-(2,6-dimethyl-3-nitro-4-pyridinyl)-4-(diphenylmethyl)-N-methyl-, hydrochloride, hydrate (1:3:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Piperazineethanamine, N-(2,6-dimethyl-3-nitro-4-pyridinyl)-4-(diphenylmethyl)-N-methyl-, hydrochloride, hydrate (1:3:1)?
Yes, KEHONG BIO provides custom synthesis services for 1-Piperazineethanamine, N-(2,6-dimethyl-3-nitro-4-pyridinyl)-4-(diphenylmethyl)-N-methyl-, hydrochloride, hydrate (1:3:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.