1-Piperazineethanamine, 4-((4-chlorophenyl)phenylmethyl)-N-(2,6-dimethyl-3-nitro-4-pyridinyl)-, hydrochloride, hydrate (1:3:2)
TL;DR: 1-Piperazineethanamine, 4-((4-chlorophenyl)phenylmethyl)-N-(2,6-dimethyl-3-nitro-4-pyridinyl)-, hydrochloride, hydrate (1:3:2) (CAS 110629-36-2) is a chemical compound with molecular formula C26H33Cl4N5O2 and molecular weight 587.13885 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[2-[4-[(4-chlorophenyl)-phenylmethyl]piperazin-1-yl]ethyl]-2,6-dimethyl-3-nitropyridin-4-amine;trihydrochloride
Also Known As: 1-Piperazineethanamine, 4-((4-chlorophenyl)phenylmethyl)-N-(2,6-dimethyl-3-nitro-4-pyridinyl)-, hydrochloride, hydrate (1:3:2), N-[2-[4-[(4-chlorophenyl)-phenyl-methyl]piperazin-1-yl]ethyl]-2,6-dimethyl-3-nitro-pyridin-4-amine trihydrochloride, N-(2-{4-[(4-Chlorophenyl)(phenyl)methyl]piperazin-1-yl}ethyl)-2,6-dimethyl-3-nitropyridin-4(1H)-imine--hydrogen chloride (1/3), N-[2-[4-[(4-chlorophenyl)-phenylmethyl]piperazin-1-yl]ethyl]-2,6-dimethyl-3-nitropyridin-4-amine trihydrochloride, N-[2-[4-[(4-chlorophenyl)-phenylmethyl]piperazin-1-yl]ethyl]-2,6-dimethyl-3-nitropyridin-4-amine,trihydrochloride
Technical Specifications
| Molecular Formula | C26H33Cl4N5O2 |
| Molecular Weight | 587.13885 g/mol |
| XLogP | 6.34454 |
| Topological Polar Surface Area (TPSA) | 77.2 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 587.13885 Da |
| Heavy Atoms | 37 |
| Complexity | 627.0 |
| SMILES | CC1=CC(=C(C(=N1)C)[N+](=O)[O-])NCCN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=C(C=C4)Cl.Cl.Cl.Cl |
| InChIKey | PVCHCISCQYSSGL-UHFFFAOYSA-N |
Chemical Property Profile of 1-Piperazineethanamine, 4-((4-chlorophenyl)phenylmethyl)-N-(2,6-dimethyl-3-nitro-4-pyridinyl)-, hydrochloride, hydrate (1:3:2)
Property Insights of 1-Piperazineethanamine, 4-((4-chlorophenyl)phenylmethyl)-N-(2,6-dimethyl-3-nitro-4-pyridinyl)-, hydrochloride, hydrate (1:3:2)
The XLogP value of 6.34454 indicates that 1-Piperazineethanamine, 4-((4-chlorophenyl)phenylmethyl)-N-(2,6-dimethyl-3-nitro-4-pyridinyl)-, hydrochloride, hydrate (1:3:2) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Piperazineethanamine, 4-((4-chlorophenyl)phenylmethyl)-N-(2,6-dimethyl-3-nitro-4-pyridinyl)-, hydrochloride, hydrate (1:3:2). Following Lipinski's Rule of Five, 1-Piperazineethanamine, 4-((4-chlorophenyl)phenylmethyl)-N-(2,6-dimethyl-3-nitro-4-pyridinyl)-, hydrochloride, hydrate (1:3:2) has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 1-Piperazineethanamine, 4-((4-chlorophenyl)phenylmethyl)-N-(2,6-dimethyl-3-nitro-4-pyridinyl)-, hydrochloride, hydrate (1:3:2)?
The CAS number of 1-Piperazineethanamine, 4-((4-chlorophenyl)phenylmethyl)-N-(2,6-dimethyl-3-nitro-4-pyridinyl)-, hydrochloride, hydrate (1:3:2) is 110629-36-2.
What is the molecular formula of 1-Piperazineethanamine, 4-((4-chlorophenyl)phenylmethyl)-N-(2,6-dimethyl-3-nitro-4-pyridinyl)-, hydrochloride, hydrate (1:3:2)?
The molecular formula of 1-Piperazineethanamine, 4-((4-chlorophenyl)phenylmethyl)-N-(2,6-dimethyl-3-nitro-4-pyridinyl)-, hydrochloride, hydrate (1:3:2) is C26H33Cl4N5O2.
What is the molecular weight of 1-Piperazineethanamine, 4-((4-chlorophenyl)phenylmethyl)-N-(2,6-dimethyl-3-nitro-4-pyridinyl)-, hydrochloride, hydrate (1:3:2)?
The molecular weight of 1-Piperazineethanamine, 4-((4-chlorophenyl)phenylmethyl)-N-(2,6-dimethyl-3-nitro-4-pyridinyl)-, hydrochloride, hydrate (1:3:2) is 587.13885 g/mol.
Where can I buy 1-Piperazineethanamine, 4-((4-chlorophenyl)phenylmethyl)-N-(2,6-dimethyl-3-nitro-4-pyridinyl)-, hydrochloride, hydrate (1:3:2)?
You can request a quote for 1-Piperazineethanamine, 4-((4-chlorophenyl)phenylmethyl)-N-(2,6-dimethyl-3-nitro-4-pyridinyl)-, hydrochloride, hydrate (1:3:2) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Piperazineethanamine, 4-((4-chlorophenyl)phenylmethyl)-N-(2,6-dimethyl-3-nitro-4-pyridinyl)-, hydrochloride, hydrate (1:3:2)?
Yes, CoreyChem provides custom synthesis services for 1-Piperazineethanamine, 4-((4-chlorophenyl)phenylmethyl)-N-(2,6-dimethyl-3-nitro-4-pyridinyl)-, hydrochloride, hydrate (1:3:2) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.