AC1N696F
2-(1-adamantyl)-N-[[4-chloro-3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]acetamide
Also Known As: N-{[4-chloro-3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}-2-(tricyclo[3.3.1.1~3,7~]dec-1-yl)acetamide|2-(1-adamantyl)-N-[[4-chloro-3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]acetamide|2-(1-adamantyl)-N-[[4-chloro-3-(6-methylbenzooxazol-2-yl)phenyl]thiocarbamoyl]acetamide|2-(Adamantan-1-yl)-N-{[4-chloro-3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}acetamide|TRICYCLO[3.3.1.13,7]DECANE-1-ACETAMIDE, N-[[[4-CHLORO-3-(6-METHYL-2-BENZOXAZOLYL)PHENYL]AMINO]THIOXOMETHYL]-
| Molecular Formula | C27H28ClN3O2S |
|---|---|
| Molecular Weight | 493.1591 g/mol |
| LogP | 6.87612 |
| Topological Polar Surface Area | 67.16 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 493.1591 |
| Monoisotopic Mass | 493.1591 |
| Heavy Atoms | 34 |
| Complexity | 1264.983 |
Chemical Identifiers
| CAS Number | 593238-63-2 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)N=C(O2)C3=C(C=CC(=C3)NC(=S)NC(=O)CC45CC6CC(C4)CC(C6)C5)Cl |
Product Overview
AC1N696F (CAS 593238-63-2), with molecular formula C27H28ClN3O2S and molecular weight 493.1591 g/mol. IUPAC: 2-(1-adamantyl)-N-[[4-chloro-3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]acetamide.
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