2-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-8-methyl-4H-thieno[3,2-c][1]benzopyran-4-one
Chemical Structure Depiction of
2-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-8-methyl-4H-thieno[3,2-c][1]benzopyran-4-one
2-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-8-methyl-4H-thieno[3,2-c][1]benzopyran-4-one
Compound characteristics
| Compound ID: | C593-1127 |
| Compound Name: | 2-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-8-methyl-4H-thieno[3,2-c][1]benzopyran-4-one |
| Molecular Weight: | 385.44 |
| Molecular Formula: | C20 H19 N O5 S |
| Smiles: | Cc1ccc2c(c1)c1c(cc(C(N3CCC4(CC3)OCCO4)=O)s1)C(=O)O2 |
| Stereo: | ACHIRAL |
| logP: | 3.0635 |
| logD: | 3.0635 |
| logSw: | -3.3165 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.992 |
| InChI Key: | VCJZRKZENAILGL-UHFFFAOYSA-N |