ChemDiv3_005811
3-(3-chloro-1,2,4-triazol-1-yl)-N-[4-(dimethylamino)phenyl]adamantane-1-carboxamide
Also Known As: ChemDiv3_005811|IDI1_023721|AK-968/40733764|SR-01000113779-1|BRD-A98372963-001-01-6|3-(3-CHLORO-1,2,4-TRIAZOL-1-YL)-N-[4-(DIMETHYLAMINO)PHENYL]ADAMANTANE-1-CARBOXAMIDE|3-(3-chloro-1H-1,2,4-triazol-1-yl)-N-[4-(dimethylamino)phenyl]-1-adamantanecarboxamide|3-(3-chloro-1H-1,2,4-triazol-1-yl)-N-[4-(dimethylamino)phenyl]tricyclo[3.3.1.1~3,7~]decane-1-carboxamide|3-(3-chloro-1,2,4-triazol-1-yl)-N-(4-dimethylaminophenyl)adamantane-1-carboxamide|3-(3-chloro-1H-1,2,4-triazol-1-yl)-N-[4-(dimethylamino)phenyl]adamantane-1-carboxamide
| Molecular Formula | C21H26ClN5O |
|---|---|
| Molecular Weight | 399.1826 g/mol |
| LogP | 3.9317 |
| Topological Polar Surface Area | 63.05 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 399.1826 |
| Monoisotopic Mass | 399.1826 |
| Heavy Atoms | 28 |
| Complexity | 891.7747 |
Chemical Identifiers
| CAS Number | 515151-32-3 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)NC(=O)C23CC4CC(C2)CC(C4)(C3)N5C=NC(=N5)Cl |
Product Overview
ChemDiv3_005811 (CAS 515151-32-3), with molecular formula C21H26ClN5O and molecular weight 399.1826 g/mol. IUPAC: 3-(3-chloro-1,2,4-triazol-1-yl)-N-[4-(dimethylamino)phenyl]adamantane-1-carboxamide.
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