AC1MRPEN
6-imino-7-[2-(4-methoxyphenyl)ethyl]-2-oxo-N-(1-phenylethyl)-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide
Also Known As: 2-imino-1-[2-(4-methoxyphenyl)ethyl]-5-oxo-N-(1-phenylethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide|2-imino-1-(4-methoxyphenethyl)-5-oxo-N-(1-phenylethyl)-2,5-dihydro-1H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
| Molecular Formula | C29H27N5O3 |
|---|---|
| Molecular Weight | 493.2114 g/mol |
| LogP | 3.87097 |
| Topological Polar Surface Area | 101.48 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 493.2114 |
| Monoisotopic Mass | 493.2114 |
| Heavy Atoms | 37 |
| Complexity | 1706.4651 |
Chemical Identifiers
| CAS Number | 858753-75-0 |
|---|---|
| SMILES | CC(C1=CC=CC=C1)NC(=O)C2=CC3=C(N=C4C=CC=CN4C3=O)N(C2=N)CCC5=CC=C(C=C5)OC |
Product Overview
AC1MRPEN (CAS 858753-75-0), with molecular formula C29H27N5O3 and molecular weight 493.2114 g/mol. IUPAC: 6-imino-7-[2-(4-methoxyphenyl)ethyl]-2-oxo-N-(1-phenylethyl)-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide.
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