N-[(5-bromo-2-methoxyphenyl)methyl]-9'-hydroxy-1'-methyl-8',9'-dihydrospiro[cyclohexane-1,7'-furo[3,2-f][1]benzopyran]-2'-carboxamide
Chemical Structure Depiction of
N-[(5-bromo-2-methoxyphenyl)methyl]-9'-hydroxy-1'-methyl-8',9'-dihydrospiro[cyclohexane-1,7'-furo[3,2-f][1]benzopyran]-2'-carboxamide
N-[(5-bromo-2-methoxyphenyl)methyl]-9'-hydroxy-1'-methyl-8',9'-dihydrospiro[cyclohexane-1,7'-furo[3,2-f][1]benzopyran]-2'-carboxamide
Compound characteristics
| Compound ID: | C798-0531 |
| Compound Name: | N-[(5-bromo-2-methoxyphenyl)methyl]-9'-hydroxy-1'-methyl-8',9'-dihydrospiro[cyclohexane-1,7'-furo[3,2-f][1]benzopyran]-2'-carboxamide |
| Molecular Weight: | 514.42 |
| Molecular Formula: | C26 H28 Br N O5 |
| Smiles: | Cc1c2c3C(CC4(CCCCC4)Oc3ccc2oc1C(NCc1cc(ccc1OC)[Br])=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.5441 |
| logD: | 5.5441 |
| logSw: | -5.512 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.16 |
| InChI Key: | ATOSZZOHFNYRLN-SFHVURJKSA-N |