N-[(3-methoxyphenyl)methyl]-7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-amine
Chemical Structure Depiction of
N-[(3-methoxyphenyl)methyl]-7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-amine
N-[(3-methoxyphenyl)methyl]-7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-amine
Compound characteristics
| Compound ID: | E679-0808 |
| Compound Name: | N-[(3-methoxyphenyl)methyl]-7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-amine |
| Molecular Weight: | 323.4 |
| Molecular Formula: | C18 H21 N5 O |
| Smiles: | COc1cccc(CNc2c3c(ncn2)n2CCCCCc2n3)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.9169 |
| logD: | 2.9151 |
| logSw: | -3.2322 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.628 |
| InChI Key: | MVKLEZUTVNFOAZ-UHFFFAOYSA-N |