10-(4-ethoxyphenyl)-3-(2-methoxyethyl)-1-methyl-7,8,9,10-tetrahydro-1H-[1,3]diazepino[2,1-f]purine-2,4(3H,6H)-dione
Chemical Structure Depiction of
10-(4-ethoxyphenyl)-3-(2-methoxyethyl)-1-methyl-7,8,9,10-tetrahydro-1H-[1,3]diazepino[2,1-f]purine-2,4(3H,6H)-dione
10-(4-ethoxyphenyl)-3-(2-methoxyethyl)-1-methyl-7,8,9,10-tetrahydro-1H-[1,3]diazepino[2,1-f]purine-2,4(3H,6H)-dione
Compound characteristics
| Compound ID: | 8255-0997 |
| Compound Name: | 10-(4-ethoxyphenyl)-3-(2-methoxyethyl)-1-methyl-7,8,9,10-tetrahydro-1H-[1,3]diazepino[2,1-f]purine-2,4(3H,6H)-dione |
| Molecular Weight: | 413.48 |
| Molecular Formula: | C21 H27 N5 O4 |
| Smiles: | CCOc1ccc(cc1)N1CCCCn2c3C(N(CCOC)C(N(C)c3nc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8671 |
| logD: | 2.867 |
| logSw: | -3.0602 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 60.83 |
| InChI Key: | PARKAWDOKWCGIU-UHFFFAOYSA-N |