methyl 4-({3-methyl-4-oxo-6-[(2-phenylethyl)carbamoyl]-1,3-thiazinan-2-ylidene}amino)benzoate
Chemical Structure Depiction of
methyl 4-({3-methyl-4-oxo-6-[(2-phenylethyl)carbamoyl]-1,3-thiazinan-2-ylidene}amino)benzoate
methyl 4-({3-methyl-4-oxo-6-[(2-phenylethyl)carbamoyl]-1,3-thiazinan-2-ylidene}amino)benzoate
Compound characteristics
| Compound ID: | 2738-0405 |
| Compound Name: | methyl 4-({3-methyl-4-oxo-6-[(2-phenylethyl)carbamoyl]-1,3-thiazinan-2-ylidene}amino)benzoate |
| Molecular Weight: | 425.51 |
| Molecular Formula: | C22 H23 N3 O4 S |
| Smiles: | CN1\C(=N/c2ccc(cc2)C(=O)OC)SC(CC1=O)C(NCCc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.66 |
| logD: | 2.6594 |
| logSw: | -3.0756 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.513 |
| InChI Key: | ADOGPUFGFUQERC-IPVOUAOMSA-N |