N,N'-butane-1,4-diylbis(4-nitrobenzamide)
TL;DR: N,N'-butane-1,4-diylbis(4-nitrobenzamide) (CAS 34062-77-6) is a chemical compound with molecular formula C18H18N4O6 and molecular weight 386.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-nitro-N-[4-[(4-nitrobenzoyl)amino]butyl]benzamide
Also Known As: 4-Carbmethoxy-2-methylindole, 4-nitro-N-[4-[(4-nitrobenzoyl)amino]butyl]benzamide, N,N'-butane-1,4-diylbis(4-nitrobenzamide), Benzamide, N,N'-1,4-butanediylbis[4-nitro-, J1.895.393E
| Molecular Formula | C18H18N4O6 |
|---|---|
| Molecular Weight | 386.12 g/mol |
| LogP | 2.443 |
| Topological Polar Surface Area | 144.48 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 386.12262 |
| Heavy Atoms | 28 |
| Complexity | 791.1495 |
Chemical Identifiers
| CAS Number | 34062-77-6 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)NCCCCNC(=O)C2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
N,N'-butane-1,4-diylbis(4-nitrobenzamide) (CAS 34062-77-6), with molecular formula C18H18N4O6 and molecular weight 386.12 g/mol. IUPAC: 4-nitro-N-[4-[(4-nitrobenzoyl)amino]butyl]benzamide.
Chemical Property Profile of N,N'-butane-1,4-diylbis(4-nitrobenzamide)
Property Insights of N,N'-butane-1,4-diylbis(4-nitrobenzamide)
The XLogP value of 2.443 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N'-butane-1,4-diylbis(4-nitrobenzamide). The TPSA of 144.48 Ų indicates high polarity, suggesting N,N'-butane-1,4-diylbis(4-nitrobenzamide) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N,N'-butane-1,4-diylbis(4-nitrobenzamide) 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 N,N'-butane-1,4-diylbis(4-nitrobenzamide)?
The CAS number of N,N'-butane-1,4-diylbis(4-nitrobenzamide) is 34062-77-6.
What is the molecular formula of N,N'-butane-1,4-diylbis(4-nitrobenzamide)?
The molecular formula of N,N'-butane-1,4-diylbis(4-nitrobenzamide) is C18H18N4O6.
What is the molecular weight of N,N'-butane-1,4-diylbis(4-nitrobenzamide)?
The molecular weight of N,N'-butane-1,4-diylbis(4-nitrobenzamide) is 386.12 g/mol.
Where can I buy N,N'-butane-1,4-diylbis(4-nitrobenzamide)?
You can request a quote for N,N'-butane-1,4-diylbis(4-nitrobenzamide) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N'-butane-1,4-diylbis(4-nitrobenzamide)?
Yes, KEHONG BIO provides custom synthesis services for N,N'-butane-1,4-diylbis(4-nitrobenzamide) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.