propan-2-yl [4-(3-fluoro-4-methylphenyl)-1,1,3-trioxo-3,4-dihydro-1lambda~6~-pyrido[2,3-e][1,2,4]thiadiazin-2(1H)-yl]acetate
Chemical Structure Depiction of
propan-2-yl [4-(3-fluoro-4-methylphenyl)-1,1,3-trioxo-3,4-dihydro-1lambda~6~-pyrido[2,3-e][1,2,4]thiadiazin-2(1H)-yl]acetate
propan-2-yl [4-(3-fluoro-4-methylphenyl)-1,1,3-trioxo-3,4-dihydro-1lambda~6~-pyrido[2,3-e][1,2,4]thiadiazin-2(1H)-yl]acetate
Compound characteristics
| Compound ID: | P799-0607 |
| Compound Name: | propan-2-yl [4-(3-fluoro-4-methylphenyl)-1,1,3-trioxo-3,4-dihydro-1lambda~6~-pyrido[2,3-e][1,2,4]thiadiazin-2(1H)-yl]acetate |
| Molecular Weight: | 407.42 |
| Molecular Formula: | C18 H18 F N3 O5 S |
| Smiles: | CC(C)OC(CN1C(N(c2ccc(C)c(c2)F)c2c(cccn2)S1(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3686 |
| logD: | 2.3686 |
| logSw: | -2.7052 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 76.788 |
| InChI Key: | OHBUAEWEBVJMAH-UHFFFAOYSA-N |