1'-methyl-N-[3-(morpholin-4-yl)propyl]-9'-oxo-8',9'-dihydrospiro[cycloheptane-1,7'-furo[3,2-f][1]benzopyran]-2'-carboxamide
Chemical Structure Depiction of
1'-methyl-N-[3-(morpholin-4-yl)propyl]-9'-oxo-8',9'-dihydrospiro[cycloheptane-1,7'-furo[3,2-f][1]benzopyran]-2'-carboxamide
1'-methyl-N-[3-(morpholin-4-yl)propyl]-9'-oxo-8',9'-dihydrospiro[cycloheptane-1,7'-furo[3,2-f][1]benzopyran]-2'-carboxamide
Compound characteristics
| Compound ID: | E003-1050 |
| Compound Name: | 1'-methyl-N-[3-(morpholin-4-yl)propyl]-9'-oxo-8',9'-dihydrospiro[cycloheptane-1,7'-furo[3,2-f][1]benzopyran]-2'-carboxamide |
| Molecular Weight: | 454.57 |
| Molecular Formula: | C26 H34 N2 O5 |
| Smiles: | Cc1c2c3C(CC4(CCCCCC4)Oc3ccc2oc1C(NCCCN1CCOCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3428 |
| logD: | 2.9546 |
| logSw: | -4.0144 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.225 |
| InChI Key: | XMQTXAAXVRTODI-UHFFFAOYSA-N |