TL;DR: [2-(cyclohexylmethylamino)-2-oxoethyl] 2-[[4-(dimethylamino)phenyl]diazenyl]benzoate (CAS 1164498-06-9) is a chemical compound with molecular formula C24H30N4O3 and molecular weight 422.23178 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2-(cyclohexylmethylamino)-2-oxoethyl] 2-[[4-(dimethylamino)phenyl]diazenyl]benzoate
Also Known As: [2-(cyclohexylmethylamino)-2-oxoethyl] 2-[[4-(dimethylamino)phenyl]diazenyl]benzoate, [2-(cyclohexylmethylamino)-2-oxoethyl] 2-[(4-dimethylaminophenyl)diazenyl]benzoate, 2-[4-(dimethylamino)phenyl]azobenzoic acid [2-(cyclohexylmethylamino)-2-keto-ethyl] ester, 2-[4-(dimethylamino)phenyl]azobenzoic acid [2-(cyclohexylmethylamino)-2-oxoethyl] ester, [2-(cyclohexylmethylamino)-2-oxidanylidene-ethyl] 2-[[4-(dimethylamino)phenyl]diazenyl]benzoate
| Molecular Formula | C24H30N4O3 |
| Molecular Weight | 422.23178 g/mol |
| XLogP | 5.4 |
| Topological Polar Surface Area (TPSA) | 83.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 422.23178 Da |
| Heavy Atoms | 31 |
| Complexity | 596.0 |
| SMILES | CN(C)C1=CC=C(C=C1)N=NC2=CC=CC=C2C(=O)OCC(=O)NCC3CCCCC3 |
| InChIKey | FIWOJDHHIMLTPK-UHFFFAOYSA-N |
The XLogP value of 5.4 indicates that [2-(cyclohexylmethylamino)-2-oxoethyl] 2-[[4-(dimethylamino)phenyl]diazenyl]benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.4 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-(cyclohexylmethylamino)-2-oxoethyl] 2-[[4-(dimethylamino)phenyl]diazenyl]benzoate. Following Lipinski's Rule of Five, [2-(cyclohexylmethylamino)-2-oxoethyl] 2-[[4-(dimethylamino)phenyl]diazenyl]benzoate has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of [2-(cyclohexylmethylamino)-2-oxoethyl] 2-[[4-(dimethylamino)phenyl]diazenyl]benzoate is 1164498-06-9.
The molecular formula of [2-(cyclohexylmethylamino)-2-oxoethyl] 2-[[4-(dimethylamino)phenyl]diazenyl]benzoate is C24H30N4O3.
The molecular weight of [2-(cyclohexylmethylamino)-2-oxoethyl] 2-[[4-(dimethylamino)phenyl]diazenyl]benzoate is 422.23178 g/mol.
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