AC1O5YKY
(6Z)-6-benzylidene-1,7,12-trimethyl-3-(2-methylpropyl)-1,4,7,10-tetrazacyclododecane-2,5,8,11-tetrone
Also Known As: Cyclo(N-methyl-D-alanylglycyl-alpha,beta-didehydro-N-methylphenylalanyl-L-leucyl)|(6Z)-6-benzylidene-1,7,12-trimethyl-3-(2-methylpropyl)-1,4,7,10-tetrazacyclododecane-2,5,8,11-tetrone
CAS: 67683-83-4
| Molecular Formula | C22H30N4O4 |
|---|---|
| Molecular Weight | 414.2267 g/mol |
| LogP | 0.9935 |
| Topological Polar Surface Area | 98.82 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 414.2267 |
| Monoisotopic Mass | 414.2267 |
| Heavy Atoms | 30 |
| Complexity | 834.79913 |
Chemical Identifiers
| CAS Number | 67683-83-4 |
|---|---|
| SMILES | CC1C(=O)NCC(=O)N(/C(=C\C2=CC=CC=C2)/C(=O)NC(C(=O)N1C)CC(C)C)C |
Product Overview
AC1O5YKY (CAS 67683-83-4), with molecular formula C22H30N4O4 and molecular weight 414.2267 g/mol. IUPAC: (6Z)-6-benzylidene-1,7,12-trimethyl-3-(2-methylpropyl)-1,4,7,10-tetrazacyclododecane-2,5,8,11-tetrone.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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