methyl 2-[(3-chloro-4-fluorophenyl)imino]-4-oxo-3-[(thiophen-2-yl)methyl]-3,4-dihydro-2H-1,3-thiazine-6-carboxylate
Chemical Structure Depiction of
methyl 2-[(3-chloro-4-fluorophenyl)imino]-4-oxo-3-[(thiophen-2-yl)methyl]-3,4-dihydro-2H-1,3-thiazine-6-carboxylate
methyl 2-[(3-chloro-4-fluorophenyl)imino]-4-oxo-3-[(thiophen-2-yl)methyl]-3,4-dihydro-2H-1,3-thiazine-6-carboxylate
Compound characteristics
| Compound ID: | C636-2184 |
| Compound Name: | methyl 2-[(3-chloro-4-fluorophenyl)imino]-4-oxo-3-[(thiophen-2-yl)methyl]-3,4-dihydro-2H-1,3-thiazine-6-carboxylate |
| Molecular Weight: | 410.87 |
| Molecular Formula: | C17 H12 Cl F N2 O3 S2 |
| Smiles: | COC(C1=CC(N(Cc2cccs2)/C(=N/c2ccc(c(c2)[Cl])F)S1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1947 |
| logD: | 4.1947 |
| logSw: | -4.4586 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 47.24 |
| InChI Key: | TWNLVMIRYAYDMW-UHFFFAOYSA-N |