N1-(4-chloro-2-nitrophenyl)-N3,N3-dimethylpropane-1,3-diamine
TL;DR: N1-(4-chloro-2-nitrophenyl)-N3,N3-dimethylpropane-1,3-diamine (CAS 56756-20-8) is a chemical compound with molecular formula C11H16ClN3O2 and molecular weight 257.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-chloro-2-nitrophenyl)-N',N'-dimethylpropane-1,3-diamine
Also Known As: BAS 00253647, N1-(4-chloro-2-nitrophenyl)-N3,N3-dimethylpropane-1,3-diamine, (3-[(4-chloro-2-nitrophenyl)amino]propyl)dimethylamine, {3-[(4-chloro-2-nitrophenyl)amino]propyl}dimethylamine, N-(4-chloro-2-nitrophenyl)-N',N'-dimethylpropane-1,3-diamine
| Molecular Formula | C11H16ClN3O2 |
|---|---|
| Molecular Weight | 257.09 g/mol |
| LogP | 2.6118 |
| Topological Polar Surface Area | 58.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 257.0931 |
| Heavy Atoms | 17 |
| Complexity | 396.30298 |
Chemical Identifiers
| CAS Number | 56756-20-8 |
|---|---|
| SMILES | CN(C)CCCNC1=C(C=C(C=C1)Cl)[N+](=O)[O-] |
Product Overview
N1-(4-chloro-2-nitrophenyl)-N3,N3-dimethylpropane-1,3-diamine (CAS 56756-20-8), with molecular formula C11H16ClN3O2 and molecular weight 257.09 g/mol. IUPAC: N-(4-chloro-2-nitrophenyl)-N',N'-dimethylpropane-1,3-diamine.
Chemical Property Profile of N1-(4-chloro-2-nitrophenyl)-N3,N3-dimethylpropane-1,3-diamine
Property Insights of N1-(4-chloro-2-nitrophenyl)-N3,N3-dimethylpropane-1,3-diamine
The XLogP value of 2.6118 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N1-(4-chloro-2-nitrophenyl)-N3,N3-dimethylpropane-1,3-diamine. With a topological polar surface area (TPSA) of 58.41 Ų, N1-(4-chloro-2-nitrophenyl)-N3,N3-dimethylpropane-1,3-diamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N1-(4-chloro-2-nitrophenyl)-N3,N3-dimethylpropane-1,3-diamine has 1 hydrogen bond donor(s) and 4 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 N1-(4-chloro-2-nitrophenyl)-N3,N3-dimethylpropane-1,3-diamine?
The CAS number of N1-(4-chloro-2-nitrophenyl)-N3,N3-dimethylpropane-1,3-diamine is 56756-20-8.
What is the molecular formula of N1-(4-chloro-2-nitrophenyl)-N3,N3-dimethylpropane-1,3-diamine?
The molecular formula of N1-(4-chloro-2-nitrophenyl)-N3,N3-dimethylpropane-1,3-diamine is C11H16ClN3O2.
What is the molecular weight of N1-(4-chloro-2-nitrophenyl)-N3,N3-dimethylpropane-1,3-diamine?
The molecular weight of N1-(4-chloro-2-nitrophenyl)-N3,N3-dimethylpropane-1,3-diamine is 257.09 g/mol.
Where can I buy N1-(4-chloro-2-nitrophenyl)-N3,N3-dimethylpropane-1,3-diamine?
You can request a quote for N1-(4-chloro-2-nitrophenyl)-N3,N3-dimethylpropane-1,3-diamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N1-(4-chloro-2-nitrophenyl)-N3,N3-dimethylpropane-1,3-diamine?
Yes, KEHONG BIO provides custom synthesis services for N1-(4-chloro-2-nitrophenyl)-N3,N3-dimethylpropane-1,3-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.