N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-3-methyl-1-benzofuran-2-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-3-methyl-1-benzofuran-2-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-3-methyl-1-benzofuran-2-carboxamide
Compound characteristics
| Compound ID: | K786-0795 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-3-methyl-1-benzofuran-2-carboxamide |
| Molecular Weight: | 514.55 |
| Molecular Formula: | C25 H26 N2 O8 S |
| Smiles: | Cc1c2cc(ccc2oc1C(NCc1ccc2c(c1)OCO2)=O)S(N1CCC2(CC1)OCCO2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3478 |
| logD: | 3.3478 |
| logSw: | -3.7136 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 96.441 |
| InChI Key: | WAWPAOHSWCBWQI-UHFFFAOYSA-N |