![(1E)-3-(4-Nitrophenyl)-1-[(2,2,7,7-tetramethyltetrahydro-2H,3aH,7H-bis[1,3]dioxolo[4,5-b:4',5'-d]pyran-5-yl)methyl]triaz-1-ene structure](/static/products/6310/63108-74-7.webp)
(1E)-3-(4-Nitrophenyl)-1-[(2,2,7,7-tetramethyltetrahydro-2H,3aH,7H-bis[1,3]dioxolo[4,5-b:4',5'-d]pyran-5-yl)methyl]triaz-1-ene
TL;DR: (1E)-3-(4-Nitrophenyl)-1-[(2,2,7,7-tetramethyltetrahydro-2H,3aH,7H-bis[1,3]dioxolo[4,5-b:4',5'-d]pyran-5-yl)methyl]triaz-1-ene (CAS 63108-74-7) is a chemical compound with molecular formula C18H24N4O7 and molecular weight 408.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-nitro-N-[(4,4,11,11-tetramethyl-3,5,7,10,12-pentaoxatricyclo[7.3.0.02,6]dodecan-8-yl)methyldiazenyl]aniline
Also Known As: (1E)-3-(4-Nitrophenyl)-1-[(2,2,7,7-tetramethyltetrahydro-2H,3aH,7H-bis[1,3]dioxolo[4,5-b:4',5'-d]pyran-5-yl)methyl]triaz-1-ene, 4-nitro-N-[(4,4,11,11-tetramethyl-3,5,7,10,12-pentaoxatricyclo[7.3.0.02,6]dodecan-8-yl)methyldiazenyl]aniline
| Molecular Formula | C18H24N4O7 |
|---|---|
| Molecular Weight | 408.16 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 129.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 4 |
| Exact Mass | 408.1645 |
| Heavy Atoms | 29 |
| Complexity | 645.0 |
Chemical Identifiers
| CAS Number | 63108-74-7 |
|---|---|
| SMILES | CC1(OC2C(OC3C(C2O1)OC(O3)(C)C)CN=NNC4=CC=C(C=C4)[N+](=O)[O-])C |
| InChIKey | XKXNSKUNMZOQKQ-UHFFFAOYSA-N |
Product Overview
(1E)-3-(4-Nitrophenyl)-1-[(2,2,7,7-tetramethyltetrahydro-2H,3aH,7H-bis[1,3]dioxolo[4,5-b:4',5'-d]pyran-5-yl)methyl]triaz-1-ene (CAS 63108-74-7), with molecular formula C18H24N4O7 and molecular weight 408.16 g/mol. IUPAC: 4-nitro-N-[(4,4,11,11-tetramethyl-3,5,7,10,12-pentaoxatricyclo[7.3.0.02,6]dodecan-8-yl)methyldiazenyl]aniline.
Chemical Property Profile of (1E)-3-(4-Nitrophenyl)-1-[(2,2,7,7-tetramethyltetrahydro-2H,3aH,7H-bis[1,3]dioxolo[4,5-b:4',5'-d]pyran-5-yl)methyl]triaz-1-ene
Property Insights of (1E)-3-(4-Nitrophenyl)-1-[(2,2,7,7-tetramethyltetrahydro-2H,3aH,7H-bis[1,3]dioxolo[4,5-b:4',5'-d]pyran-5-yl)methyl]triaz-1-ene
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1E)-3-(4-Nitrophenyl)-1-[(2,2,7,7-tetramethyltetrahydro-2H,3aH,7H-bis[1,3]dioxolo[4,5-b:4',5'-d]pyran-5-yl)methyl]triaz-1-ene. The TPSA of 129.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (1E)-3-(4-Nitrophenyl)-1-[(2,2,7,7-tetramethyltetrahydro-2H,3aH,7H-bis[1,3]dioxolo[4,5-b:4',5'-d]pyran-5-yl)methyl]triaz-1-ene. Following Lipinski's Rule of Five, (1E)-3-(4-Nitrophenyl)-1-[(2,2,7,7-tetramethyltetrahydro-2H,3aH,7H-bis[1,3]dioxolo[4,5-b:4',5'-d]pyran-5-yl)methyl]triaz-1-ene has 1 hydrogen bond donor(s) and 10 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 (1E)-3-(4-Nitrophenyl)-1-[(2,2,7,7-tetramethyltetrahydro-2H,3aH,7H-bis[1,3]dioxolo[4,5-b:4',5'-d]pyran-5-yl)methyl]triaz-1-ene?
The CAS number of (1E)-3-(4-Nitrophenyl)-1-[(2,2,7,7-tetramethyltetrahydro-2H,3aH,7H-bis[1,3]dioxolo[4,5-b:4',5'-d]pyran-5-yl)methyl]triaz-1-ene is 63108-74-7.
What is the molecular formula of (1E)-3-(4-Nitrophenyl)-1-[(2,2,7,7-tetramethyltetrahydro-2H,3aH,7H-bis[1,3]dioxolo[4,5-b:4',5'-d]pyran-5-yl)methyl]triaz-1-ene?
The molecular formula of (1E)-3-(4-Nitrophenyl)-1-[(2,2,7,7-tetramethyltetrahydro-2H,3aH,7H-bis[1,3]dioxolo[4,5-b:4',5'-d]pyran-5-yl)methyl]triaz-1-ene is C18H24N4O7.
What is the molecular weight of (1E)-3-(4-Nitrophenyl)-1-[(2,2,7,7-tetramethyltetrahydro-2H,3aH,7H-bis[1,3]dioxolo[4,5-b:4',5'-d]pyran-5-yl)methyl]triaz-1-ene?
The molecular weight of (1E)-3-(4-Nitrophenyl)-1-[(2,2,7,7-tetramethyltetrahydro-2H,3aH,7H-bis[1,3]dioxolo[4,5-b:4',5'-d]pyran-5-yl)methyl]triaz-1-ene is 408.16 g/mol.
Where can I buy (1E)-3-(4-Nitrophenyl)-1-[(2,2,7,7-tetramethyltetrahydro-2H,3aH,7H-bis[1,3]dioxolo[4,5-b:4',5'-d]pyran-5-yl)methyl]triaz-1-ene?
You can request a quote for (1E)-3-(4-Nitrophenyl)-1-[(2,2,7,7-tetramethyltetrahydro-2H,3aH,7H-bis[1,3]dioxolo[4,5-b:4',5'-d]pyran-5-yl)methyl]triaz-1-ene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1E)-3-(4-Nitrophenyl)-1-[(2,2,7,7-tetramethyltetrahydro-2H,3aH,7H-bis[1,3]dioxolo[4,5-b:4',5'-d]pyran-5-yl)methyl]triaz-1-ene?
Yes, KEHONG BIO provides custom synthesis services for (1E)-3-(4-Nitrophenyl)-1-[(2,2,7,7-tetramethyltetrahydro-2H,3aH,7H-bis[1,3]dioxolo[4,5-b:4',5'-d]pyran-5-yl)methyl]triaz-1-ene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.