3-[(5-bromo-2-hydroxyphenyl)methyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Chemical Structure Depiction of
3-[(5-bromo-2-hydroxyphenyl)methyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
3-[(5-bromo-2-hydroxyphenyl)methyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Compound characteristics
| Compound ID: | N098-0051 |
| Compound Name: | 3-[(5-bromo-2-hydroxyphenyl)methyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one |
| Molecular Weight: | 375.26 |
| Molecular Formula: | C18 H19 Br N2 O2 |
| Smiles: | C1C2CN(CC1C1=CC=CC(N1C2)=O)Cc1cc(ccc1O)[Br] |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.2214 |
| logD: | 2.9833 |
| logSw: | -2.9433 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.218 |
| InChI Key: | WUPFQEDVNYNDOH-UHFFFAOYSA-N |