10-(4-ethoxyphenyl)-3-heptyl-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-heptyl-1-methyl-7,8,9,10-tetrahydro-1H-[1,3]diazepino[2,1-f]purine-2,4(3H,6H)-dione
10-(4-ethoxyphenyl)-3-heptyl-1-methyl-7,8,9,10-tetrahydro-1H-[1,3]diazepino[2,1-f]purine-2,4(3H,6H)-dione
Compound characteristics
| Compound ID: | 8255-0991 |
| Compound Name: | 10-(4-ethoxyphenyl)-3-heptyl-1-methyl-7,8,9,10-tetrahydro-1H-[1,3]diazepino[2,1-f]purine-2,4(3H,6H)-dione |
| Molecular Weight: | 453.58 |
| Molecular Formula: | C25 H35 N5 O3 |
| Smiles: | CCCCCCCN1C(c2c(nc3N(CCCCn23)c2ccc(cc2)OCC)N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.949 |
| logD: | 5.9489 |
| logSw: | -5.2432 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.487 |
| InChI Key: | RRIZQRAGJRHVPV-UHFFFAOYSA-N |