![N-[[2-[2-(5-nitrotetrazol-2-yl)acetyl]-3,4-dihydro-1H-isoquinolin-1-yl]methyl]cyclohexanecarboxamide structure](/static/products/6752/6752-54-1.webp)
N-[[2-[2-(5-nitrotetrazol-2-yl)acetyl]-3,4-dihydro-1H-isoquinolin-1-yl]methyl]cyclohexanecarboxamide
TL;DR: N-[[2-[2-(5-nitrotetrazol-2-yl)acetyl]-3,4-dihydro-1H-isoquinolin-1-yl]methyl]cyclohexanecarboxamide (CAS 6752-54-1) is a chemical compound with molecular formula C20H25N7O4 and molecular weight 427.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[2-[2-(5-nitrotetrazol-2-yl)acetyl]-3,4-dihydro-1H-isoquinolin-1-yl]methyl]cyclohexanecarboxamide
Also Known As: N-[[2-[2-(5-nitrotetrazol-2-yl)acetyl]-3,4-dihydro-1H-isoquinolin-1-yl]methyl]cyclohexanecarboxamide, N-{[2-(2-{5-nitro-2H-tetraazol-2-yl}acetyl)-1,2,3,4-tetrahydro-1-isoquinolinyl]methyl}cyclohexanecarboxamide, N-({2-[(5-Nitro-2H-tetrazol-2-yl)acetyl]-1,2,3,4-tetrahydroisoquinolin-1-yl}methyl)cyclohexanecarboxamide
| Molecular Formula | C20H25N7O4 |
|---|---|
| Molecular Weight | 427.20 g/mol |
| LogP | 1.4038 |
| Topological Polar Surface Area | 136.15 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 427.1968 |
| Heavy Atoms | 31 |
| Complexity | 969.9429 |
Chemical Identifiers
| CAS Number | 6752-54-1 |
|---|---|
| SMILES | C1CCC(CC1)C(=O)NCC2C3=CC=CC=C3CCN2C(=O)CN4N=C(N=N4)[N+](=O)[O-] |
Product Overview
N-[[2-[2-(5-nitrotetrazol-2-yl)acetyl]-3,4-dihydro-1H-isoquinolin-1-yl]methyl]cyclohexanecarboxamide (CAS 6752-54-1), with molecular formula C20H25N7O4 and molecular weight 427.20 g/mol. IUPAC: N-[[2-[2-(5-nitrotetrazol-2-yl)acetyl]-3,4-dihydro-1H-isoquinolin-1-yl]methyl]cyclohexanecarboxamide.
Chemical Property Profile of N-[[2-[2-(5-nitrotetrazol-2-yl)acetyl]-3,4-dihydro-1H-isoquinolin-1-yl]methyl]cyclohexanecarboxamide
Property Insights of N-[[2-[2-(5-nitrotetrazol-2-yl)acetyl]-3,4-dihydro-1H-isoquinolin-1-yl]methyl]cyclohexanecarboxamide
The XLogP value of 1.4038 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[[2-[2-(5-nitrotetrazol-2-yl)acetyl]-3,4-dihydro-1H-isoquinolin-1-yl]methyl]cyclohexanecarboxamide. The TPSA of 136.15 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[[2-[2-(5-nitrotetrazol-2-yl)acetyl]-3,4-dihydro-1H-isoquinolin-1-yl]methyl]cyclohexanecarboxamide. Following Lipinski's Rule of Five, N-[[2-[2-(5-nitrotetrazol-2-yl)acetyl]-3,4-dihydro-1H-isoquinolin-1-yl]methyl]cyclohexanecarboxamide has 1 hydrogen bond donor(s) and 7 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-[[2-[2-(5-nitrotetrazol-2-yl)acetyl]-3,4-dihydro-1H-isoquinolin-1-yl]methyl]cyclohexanecarboxamide?
The CAS number of N-[[2-[2-(5-nitrotetrazol-2-yl)acetyl]-3,4-dihydro-1H-isoquinolin-1-yl]methyl]cyclohexanecarboxamide is 6752-54-1.
What is the molecular formula of N-[[2-[2-(5-nitrotetrazol-2-yl)acetyl]-3,4-dihydro-1H-isoquinolin-1-yl]methyl]cyclohexanecarboxamide?
The molecular formula of N-[[2-[2-(5-nitrotetrazol-2-yl)acetyl]-3,4-dihydro-1H-isoquinolin-1-yl]methyl]cyclohexanecarboxamide is C20H25N7O4.
What is the molecular weight of N-[[2-[2-(5-nitrotetrazol-2-yl)acetyl]-3,4-dihydro-1H-isoquinolin-1-yl]methyl]cyclohexanecarboxamide?
The molecular weight of N-[[2-[2-(5-nitrotetrazol-2-yl)acetyl]-3,4-dihydro-1H-isoquinolin-1-yl]methyl]cyclohexanecarboxamide is 427.20 g/mol.
Where can I buy N-[[2-[2-(5-nitrotetrazol-2-yl)acetyl]-3,4-dihydro-1H-isoquinolin-1-yl]methyl]cyclohexanecarboxamide?
You can request a quote for N-[[2-[2-(5-nitrotetrazol-2-yl)acetyl]-3,4-dihydro-1H-isoquinolin-1-yl]methyl]cyclohexanecarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[[2-[2-(5-nitrotetrazol-2-yl)acetyl]-3,4-dihydro-1H-isoquinolin-1-yl]methyl]cyclohexanecarboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-[[2-[2-(5-nitrotetrazol-2-yl)acetyl]-3,4-dihydro-1H-isoquinolin-1-yl]methyl]cyclohexanecarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.