tert-butyl [4-(4-methylphenyl)-1,1-dioxo-3,4-dihydro-1lambda~6~-pyrido[2,3-e][1,2,4]thiadiazin-2(1H)-yl]acetate
Chemical Structure Depiction of
tert-butyl [4-(4-methylphenyl)-1,1-dioxo-3,4-dihydro-1lambda~6~-pyrido[2,3-e][1,2,4]thiadiazin-2(1H)-yl]acetate
tert-butyl [4-(4-methylphenyl)-1,1-dioxo-3,4-dihydro-1lambda~6~-pyrido[2,3-e][1,2,4]thiadiazin-2(1H)-yl]acetate
Compound characteristics
Compound ID: | P585-2114 |
Compound Name: | tert-butyl [4-(4-methylphenyl)-1,1-dioxo-3,4-dihydro-1lambda~6~-pyrido[2,3-e][1,2,4]thiadiazin-2(1H)-yl]acetate |
Molecular Weight: | 389.47 |
Molecular Formula: | C19 H23 N3 O4 S |
Smiles: | Cc1ccc(cc1)N1CN(CC(=O)OC(C)(C)C)S(c2cccnc12)(=O)=O |
Stereo: | ACHIRAL |
logP: | 3.6697 |
logD: | 3.6697 |
logSw: | -3.7785 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 64.355 |
InChI Key: | QTNVBXSSWVNPQP-UHFFFAOYSA-N |