methyl 4-({8-chloro-7-fluoro-1,1-dioxo-4-[(oxolan-2-yl)methyl]-1,2,3,4-tetrahydro-1lambda~6~-pyrido[4,3-b][1,4]thiazin-5-yl}oxy)benzoate
Chemical Structure Depiction of
methyl 4-({8-chloro-7-fluoro-1,1-dioxo-4-[(oxolan-2-yl)methyl]-1,2,3,4-tetrahydro-1lambda~6~-pyrido[4,3-b][1,4]thiazin-5-yl}oxy)benzoate
methyl 4-({8-chloro-7-fluoro-1,1-dioxo-4-[(oxolan-2-yl)methyl]-1,2,3,4-tetrahydro-1lambda~6~-pyrido[4,3-b][1,4]thiazin-5-yl}oxy)benzoate
Compound characteristics
| Compound ID: | 8610-0009 |
| Compound Name: | methyl 4-({8-chloro-7-fluoro-1,1-dioxo-4-[(oxolan-2-yl)methyl]-1,2,3,4-tetrahydro-1lambda~6~-pyrido[4,3-b][1,4]thiazin-5-yl}oxy)benzoate |
| Molecular Weight: | 470.9 |
| Molecular Formula: | C20 H20 Cl F N2 O6 S |
| Smiles: | COC(c1ccc(cc1)Oc1c2c(c(c(n1)F)[Cl])S(CCN2CC1CCCO1)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2183 |
| logD: | 3.2183 |
| logSw: | -3.9942 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 81.085 |
| InChI Key: | YZPODYUPGACULK-CQSZACIVSA-N |