N-[2-(dimethylamino)ethyl]-5-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-3-methyl-1-benzofuran-2-carboxamide
Chemical Structure Depiction of
N-[2-(dimethylamino)ethyl]-5-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-3-methyl-1-benzofuran-2-carboxamide
N-[2-(dimethylamino)ethyl]-5-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-3-methyl-1-benzofuran-2-carboxamide
Compound characteristics
| Compound ID: | C153-0351 |
| Compound Name: | N-[2-(dimethylamino)ethyl]-5-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-3-methyl-1-benzofuran-2-carboxamide |
| Molecular Weight: | 451.54 |
| Molecular Formula: | C21 H29 N3 O6 S |
| Smiles: | Cc1c2cc(ccc2oc1C(NCCN(C)C)=O)S(N1CCC2(CC1)OCCO2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7705 |
| logD: | 0.6442 |
| logSw: | -2.6963 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.304 |
| InChI Key: | NWVUVXQWWFDSJD-UHFFFAOYSA-N |