methyl 4-oxo-3-[(thiophen-2-yl)methyl]-2-{[(thiophen-2-yl)methyl]imino}-3,4-dihydro-2H-1,3-thiazine-6-carboxylate
Chemical Structure Depiction of
methyl 4-oxo-3-[(thiophen-2-yl)methyl]-2-{[(thiophen-2-yl)methyl]imino}-3,4-dihydro-2H-1,3-thiazine-6-carboxylate
methyl 4-oxo-3-[(thiophen-2-yl)methyl]-2-{[(thiophen-2-yl)methyl]imino}-3,4-dihydro-2H-1,3-thiazine-6-carboxylate
Compound characteristics
| Compound ID: | C636-2193 |
| Compound Name: | methyl 4-oxo-3-[(thiophen-2-yl)methyl]-2-{[(thiophen-2-yl)methyl]imino}-3,4-dihydro-2H-1,3-thiazine-6-carboxylate |
| Molecular Weight: | 378.49 |
| Molecular Formula: | C16 H14 N2 O3 S3 |
| Smiles: | COC(C1=CC(N(Cc2cccs2)/C(=N/Cc2cccs2)S1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4987 |
| logD: | 3.4967 |
| logSw: | -3.6015 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.777 |
| InChI Key: | ABUTXCASCOZXRU-UHFFFAOYSA-N |