4,6-Bis[(3-hydroxypropylamino)methyl]-2-nitrobenzene-1,3-diol
TL;DR: 4,6-Bis[(3-hydroxypropylamino)methyl]-2-nitrobenzene-1,3-diol (CAS 41510-33-2) is a chemical compound with molecular formula C14H23N3O6 and molecular weight 329.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,6-bis[(3-hydroxypropylamino)methyl]-2-nitrobenzene-1,3-diol
Also Known As: 4,6-bis[(3-hydroxypropylamino)methyl]-2-nitrobenzene-1,3-diol, 1, 4,6-bis[[(3-hydroxypropyl)amino]methyl]-2-nitro-, 4,6-Bis{[(3-hydroxypropyl)amino]methyl}-2-nitrobenzene-1,3-diol
| Molecular Formula | C14H23N3O6 |
|---|---|
| Molecular Weight | 329.16 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 151.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 329.1587 |
| Heavy Atoms | 23 |
| Complexity | 317.0 |
Chemical Identifiers
| CAS Number | 41510-33-2 |
|---|---|
| SMILES | C1=C(C(=C(C(=C1CNCCCO)O)[N+](=O)[O-])O)CNCCCO |
| InChIKey | SHIDJFLKHHUKOP-UHFFFAOYSA-N |
Product Overview
4,6-Bis[(3-hydroxypropylamino)methyl]-2-nitrobenzene-1,3-diol (CAS 41510-33-2), with molecular formula C14H23N3O6 and molecular weight 329.16 g/mol. IUPAC: 4,6-bis[(3-hydroxypropylamino)methyl]-2-nitrobenzene-1,3-diol.
Chemical Property Profile of 4,6-Bis[(3-hydroxypropylamino)methyl]-2-nitrobenzene-1,3-diol
Property Insights of 4,6-Bis[(3-hydroxypropylamino)methyl]-2-nitrobenzene-1,3-diol
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,6-Bis[(3-hydroxypropylamino)methyl]-2-nitrobenzene-1,3-diol. The TPSA of 151.0 Ų indicates high polarity, suggesting 4,6-Bis[(3-hydroxypropylamino)methyl]-2-nitrobenzene-1,3-diol may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4,6-Bis[(3-hydroxypropylamino)methyl]-2-nitrobenzene-1,3-diol has 6 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4,6-Bis[(3-hydroxypropylamino)methyl]-2-nitrobenzene-1,3-diol?
The CAS number of 4,6-Bis[(3-hydroxypropylamino)methyl]-2-nitrobenzene-1,3-diol is 41510-33-2.
What is the molecular formula of 4,6-Bis[(3-hydroxypropylamino)methyl]-2-nitrobenzene-1,3-diol?
The molecular formula of 4,6-Bis[(3-hydroxypropylamino)methyl]-2-nitrobenzene-1,3-diol is C14H23N3O6.
What is the molecular weight of 4,6-Bis[(3-hydroxypropylamino)methyl]-2-nitrobenzene-1,3-diol?
The molecular weight of 4,6-Bis[(3-hydroxypropylamino)methyl]-2-nitrobenzene-1,3-diol is 329.16 g/mol.
Where can I buy 4,6-Bis[(3-hydroxypropylamino)methyl]-2-nitrobenzene-1,3-diol?
You can request a quote for 4,6-Bis[(3-hydroxypropylamino)methyl]-2-nitrobenzene-1,3-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,6-Bis[(3-hydroxypropylamino)methyl]-2-nitrobenzene-1,3-diol?
Yes, KEHONG BIO provides custom synthesis services for 4,6-Bis[(3-hydroxypropylamino)methyl]-2-nitrobenzene-1,3-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.