AC1MHOVD
2-tert-butyl-1-(5-hydroxynaphthalen-1-yl)-3-(1,3-thiazol-2-yl)guanidine;nitric acid
Also Known As: Guanidine, 1-tert-butyl-2-(5-hydroxy-1-naphthyl)-3-(2-thiazolyl)-, mononitrate|Guanidine, N-(1,1-dimethylethyl)-N'-(5-hydroxy-1-naphthalenyl)-N''-2-thiazolyl-, mononitrate(salt)|2-tert-butyl-1-(5-hydroxynaphthalen-1-yl)-3-(1,3-thiazol-2-yl)guanidine; nitric acid|Nitric acid--N''-tert-butyl-N-(5-hydroxynaphthalen-1-yl)-N'-(1,3-thiazol-2-yl)guanidine (1/1)
| Molecular Formula | C18H21N5O4S |
|---|---|
| Molecular Weight | 403.13144 g/mol |
| LogP | 4.3327 |
| Topological Polar Surface Area | 132.91 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 403.13144 |
| Monoisotopic Mass | 403.13144 |
| Heavy Atoms | 28 |
| Complexity | 963.7665 |
Chemical Identifiers
| CAS Number | 72041-75-9 |
|---|---|
| SMILES | CC(C)(C)N=C(NC1=CC=CC2=C1C=CC=C2O)NC3=NC=CS3.[N+](=O)(O)[O-] |
Product Overview
AC1MHOVD (CAS 72041-75-9), with molecular formula C18H21N5O4S and molecular weight 403.13144 g/mol. IUPAC: 2-tert-butyl-1-(5-hydroxynaphthalen-1-yl)-3-(1,3-thiazol-2-yl)guanidine;nitric acid.
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