2-[(4-chlorophenyl)methylidene]-6-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
2-[(4-chlorophenyl)methylidene]-6-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-2H-1,4-benzoxazin-3(4H)-one
2-[(4-chlorophenyl)methylidene]-6-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | F389-0097 |
| Compound Name: | 2-[(4-chlorophenyl)methylidene]-6-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 440.88 |
| Molecular Formula: | C23 H21 Cl N2 O5 |
| Smiles: | C1CN(CCC12OCCO2)C(c1ccc2c(c1)NC(/C(=C/c1ccc(cc1)[Cl])O2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0008 |
| logD: | 3.0008 |
| logSw: | -3.9826 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.893 |
| InChI Key: | IWVMBISYLUUPMD-UHFFFAOYSA-N |