TL;DR: Veralgin (CAS 122114-16-3) is a chemical compound with molecular formula C38H49ClN6O7 and molecular weight 736.33514 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4R,4aR,7S,7aR,12bS)-9-ethoxy-3-methyl-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-ol;4-amino-1,5-dimethyl-2-phenylpyrazol-3-one;5,5-diethyl-1,3-diazinane-2,4,6-trione;hydrochloride
Also Known As: Veralgin, Aminopyrine mixture with Barbital and Ethylmorphine, 7,8-Didehydro-4,5-epoxy-3-ethoxy-17-methylmorphinan-6-ol hydrochloride, (5alpha,6alpha)-, mixt. with 4-amino-1,2-dihydro-1,5-dimethyl-2-phenyl-3H-pyrazol-3-one and 5,5-diethyl-2,4,6(1H,3H,5H)-pyrimidinetrione, 5-Pyrimidinecarboxylic acid,4-amino-2-(1-piperidinyl)-,methyl ester,hydrochloride, (4R,4aR,7S,7aR,12bS)-9-ethoxy-3-methyl-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-ol;4-amino-1,5-dimethyl-2-phenylpyrazol-3-one;5,5-diethyl-1,3-diazinane-2,4,6-trione;hydrochloride
| Molecular Formula | C38H49ClN6O7 |
| Molecular Weight | 736.33514 g/mol |
| XLogP | 3.53842 |
| Topological Polar Surface Area (TPSA) | 167.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 5 |
| Exact Mass | 736.33514 Da |
| Heavy Atoms | 52 |
| Complexity | 1070.0 |
| SMILES | CCC1(C(=O)NC(=O)NC1=O)CC.CCOC1=C2C3=C(C[C@@H]4[C@H]5[C@]3(CCN4C)[C@@H](O2)[C@H](C=C5)O)C=C1.CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N.Cl |
| InChIKey | FDBJOJMJXVZQEH-VSYPDCRNSA-N |
The XLogP value of 3.53842 indicates that Veralgin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 167.0 Ų indicates high polarity, suggesting Veralgin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Veralgin has 5 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Veralgin is 122114-16-3.
The molecular formula of Veralgin is C38H49ClN6O7.
The molecular weight of Veralgin is 736.33514 g/mol.
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