4-[(2-chloro-6-fluorophenyl)methyl]-6-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-2H-1,4-benzothiazin-3(4H)-one
Chemical Structure Depiction of
4-[(2-chloro-6-fluorophenyl)methyl]-6-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-2H-1,4-benzothiazin-3(4H)-one
4-[(2-chloro-6-fluorophenyl)methyl]-6-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
| Compound ID: | C122-0629 |
| Compound Name: | 4-[(2-chloro-6-fluorophenyl)methyl]-6-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-2H-1,4-benzothiazin-3(4H)-one |
| Molecular Weight: | 476.95 |
| Molecular Formula: | C23 H22 Cl F N2 O4 S |
| Smiles: | C1CN(CCC12OCCO2)C(c1ccc2c(c1)N(Cc1c(cccc1[Cl])F)C(CS2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8386 |
| logD: | 2.8386 |
| logSw: | -3.5328 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 46.704 |
| InChI Key: | IIWCVVSDGYJXHV-UHFFFAOYSA-N |