1'-methyl-9'-oxo-N-[3-(propylsulfanyl)propyl]-8',9'-dihydrospiro[cyclohexane-1,7'-furo[3,2-f][1]benzopyran]-2'-carboxamide
Chemical Structure Depiction of
1'-methyl-9'-oxo-N-[3-(propylsulfanyl)propyl]-8',9'-dihydrospiro[cyclohexane-1,7'-furo[3,2-f][1]benzopyran]-2'-carboxamide
1'-methyl-9'-oxo-N-[3-(propylsulfanyl)propyl]-8',9'-dihydrospiro[cyclohexane-1,7'-furo[3,2-f][1]benzopyran]-2'-carboxamide
Compound characteristics
| Compound ID: | E003-0236 |
| Compound Name: | 1'-methyl-9'-oxo-N-[3-(propylsulfanyl)propyl]-8',9'-dihydrospiro[cyclohexane-1,7'-furo[3,2-f][1]benzopyran]-2'-carboxamide |
| Molecular Weight: | 429.58 |
| Molecular Formula: | C24 H31 N O4 S |
| Smiles: | CCCSCCCNC(c1c(C)c2c3C(CC4(CCCCC4)Oc3ccc2o1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5596 |
| logD: | 4.5596 |
| logSw: | -4.8255 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.274 |
| InChI Key: | CUVCDTCVEUQMOJ-UHFFFAOYSA-N |