AC1NKRNM
6-[2-(3,4-dimethoxyphenyl)ethyl]-2-(3-hydroxypropyl)-4,7,8-trimethylpurino[7,8-a]imidazole-1,3-dione
Also Known As: VU0606637-1|8-(3,4-dimethoxyphenethyl)-3-(3-hydroxypropyl)-1,6,7-trimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione|F3235-0115|6-[2-(3,4-dimethoxyphenyl)ethyl]-2-(3-hydroxypropyl)-4,7,8-trimethylpurino[7,8-a]imidazole-1,3-dione|8-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3-hydroxypropyl)-1,6,7-trimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
| Molecular Formula | C23H29N5O5 |
|---|---|
| Molecular Weight | 455.21686 g/mol |
| LogP | 1.40854 |
| Topological Polar Surface Area | 104.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 455.21686 |
| Monoisotopic Mass | 455.21686 |
| Heavy Atoms | 33 |
| Complexity | 1456.6776 |
Chemical Identifiers
| CAS Number | 899407-72-8 |
|---|---|
| SMILES | CC1=C(N2C3=C(N=C2N1CCC4=CC(=C(C=C4)OC)OC)N(C(=O)N(C3=O)CCCO)C)C |
Product Overview
AC1NKRNM (CAS 899407-72-8), with molecular formula C23H29N5O5 and molecular weight 455.21686 g/mol. IUPAC: 6-[2-(3,4-dimethoxyphenyl)ethyl]-2-(3-hydroxypropyl)-4,7,8-trimethylpurino[7,8-a]imidazole-1,3-dione.
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