![3-[5-(4-Methylpiperazin-1-yl)-2-nitroanilino]propan-1-ol structure](/static/products/3104/310458-20-9.webp)
3-[5-(4-Methylpiperazin-1-yl)-2-nitroanilino]propan-1-ol
TL;DR: 3-[5-(4-Methylpiperazin-1-yl)-2-nitroanilino]propan-1-ol (CAS 310458-20-9) is a chemical compound with molecular formula C14H22N4O3 and molecular weight 294.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[5-(4-methylpiperazin-1-yl)-2-nitroanilino]propan-1-ol
Also Known As: 3-[5-(4-methylpiperazin-1-yl)-2-nitroanilino]propan-1-ol, A0858/0040213, 3-[5-(4-Methyl-1-piperazinyl)-2-nitroanilino]-1-propanol #, 3-{[5-(4-methylpiperazinyl)-2-nitrophenyl]amino}propan-1-ol, 3-((5-(4-methylpiperazin-1-yl)-2-nitrophenyl)amino)propan-1-ol
| Molecular Formula | C14H22N4O3 |
|---|---|
| Molecular Weight | 294.17 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 84.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 294.1692 |
| Heavy Atoms | 21 |
| Complexity | 329.0 |
Chemical Identifiers
| CAS Number | 310458-20-9 |
|---|---|
| SMILES | CN1CCN(CC1)C2=CC(=C(C=C2)[N+](=O)[O-])NCCCO |
| InChIKey | PYZXEPLLFDIQLF-UHFFFAOYSA-N |
Product Overview
3-[5-(4-Methylpiperazin-1-yl)-2-nitroanilino]propan-1-ol (CAS 310458-20-9), with molecular formula C14H22N4O3 and molecular weight 294.17 g/mol. IUPAC: 3-[5-(4-methylpiperazin-1-yl)-2-nitroanilino]propan-1-ol.
Chemical Property Profile of 3-[5-(4-Methylpiperazin-1-yl)-2-nitroanilino]propan-1-ol
Property Insights of 3-[5-(4-Methylpiperazin-1-yl)-2-nitroanilino]propan-1-ol
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[5-(4-Methylpiperazin-1-yl)-2-nitroanilino]propan-1-ol. The TPSA of 84.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[5-(4-Methylpiperazin-1-yl)-2-nitroanilino]propan-1-ol. Following Lipinski's Rule of Five, 3-[5-(4-Methylpiperazin-1-yl)-2-nitroanilino]propan-1-ol has 2 hydrogen bond donor(s) and 6 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 3-[5-(4-Methylpiperazin-1-yl)-2-nitroanilino]propan-1-ol?
The CAS number of 3-[5-(4-Methylpiperazin-1-yl)-2-nitroanilino]propan-1-ol is 310458-20-9.
What is the molecular formula of 3-[5-(4-Methylpiperazin-1-yl)-2-nitroanilino]propan-1-ol?
The molecular formula of 3-[5-(4-Methylpiperazin-1-yl)-2-nitroanilino]propan-1-ol is C14H22N4O3.
What is the molecular weight of 3-[5-(4-Methylpiperazin-1-yl)-2-nitroanilino]propan-1-ol?
The molecular weight of 3-[5-(4-Methylpiperazin-1-yl)-2-nitroanilino]propan-1-ol is 294.17 g/mol.
Where can I buy 3-[5-(4-Methylpiperazin-1-yl)-2-nitroanilino]propan-1-ol?
You can request a quote for 3-[5-(4-Methylpiperazin-1-yl)-2-nitroanilino]propan-1-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[5-(4-Methylpiperazin-1-yl)-2-nitroanilino]propan-1-ol?
Yes, KEHONG BIO provides custom synthesis services for 3-[5-(4-Methylpiperazin-1-yl)-2-nitroanilino]propan-1-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.