1-N,4-N-dicyclohexyl-2-nitrobenzene-1,4-dicarboxamide
TL;DR: 1-N,4-N-dicyclohexyl-2-nitrobenzene-1,4-dicarboxamide (CAS 446029-88-5) is a chemical compound with molecular formula C20H27N3O4 and molecular weight 373.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-N,4-N-dicyclohexyl-2-nitrobenzene-1,4-dicarboxamide
Also Known As: N~1~,N~4~-dicyclohexyl-2-nitroterephthalamide, 1-N,4-N-dicyclohexyl-2-nitrobenzene-1,4-dicarboxamide, N,N'-dicyclohexyl-2-nitrobenzene-1,4-dicarboxamide, A2803/0118475, N1,N4-DICYCLOHEXYL-2-NITROBENZENE-1,4-DICARBOXAMIDE
| Molecular Formula | C20H27N3O4 |
|---|---|
| Molecular Weight | 373.20 g/mol |
| LogP | 3.7198 |
| Topological Polar Surface Area | 101.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 373.20016 |
| Heavy Atoms | 27 |
| Complexity | 707.1784 |
Chemical Identifiers
| CAS Number | 446029-88-5 |
|---|---|
| SMILES | C1CCC(CC1)NC(=O)C2=CC(=C(C=C2)C(=O)NC3CCCCC3)[N+](=O)[O-] |
Product Overview
1-N,4-N-dicyclohexyl-2-nitrobenzene-1,4-dicarboxamide (CAS 446029-88-5), with molecular formula C20H27N3O4 and molecular weight 373.20 g/mol. IUPAC: 1-N,4-N-dicyclohexyl-2-nitrobenzene-1,4-dicarboxamide.
Chemical Property Profile of 1-N,4-N-dicyclohexyl-2-nitrobenzene-1,4-dicarboxamide
Property Insights of 1-N,4-N-dicyclohexyl-2-nitrobenzene-1,4-dicarboxamide
The XLogP value of 3.7198 indicates that 1-N,4-N-dicyclohexyl-2-nitrobenzene-1,4-dicarboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.34 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-N,4-N-dicyclohexyl-2-nitrobenzene-1,4-dicarboxamide. Following Lipinski's Rule of Five, 1-N,4-N-dicyclohexyl-2-nitrobenzene-1,4-dicarboxamide has 2 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 1-N,4-N-dicyclohexyl-2-nitrobenzene-1,4-dicarboxamide?
The CAS number of 1-N,4-N-dicyclohexyl-2-nitrobenzene-1,4-dicarboxamide is 446029-88-5.
What is the molecular formula of 1-N,4-N-dicyclohexyl-2-nitrobenzene-1,4-dicarboxamide?
The molecular formula of 1-N,4-N-dicyclohexyl-2-nitrobenzene-1,4-dicarboxamide is C20H27N3O4.
What is the molecular weight of 1-N,4-N-dicyclohexyl-2-nitrobenzene-1,4-dicarboxamide?
The molecular weight of 1-N,4-N-dicyclohexyl-2-nitrobenzene-1,4-dicarboxamide is 373.20 g/mol.
Where can I buy 1-N,4-N-dicyclohexyl-2-nitrobenzene-1,4-dicarboxamide?
You can request a quote for 1-N,4-N-dicyclohexyl-2-nitrobenzene-1,4-dicarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-N,4-N-dicyclohexyl-2-nitrobenzene-1,4-dicarboxamide?
Yes, KEHONG BIO provides custom synthesis services for 1-N,4-N-dicyclohexyl-2-nitrobenzene-1,4-dicarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.