1-[(4-chlorophenyl)methyl]-3-[(4-methoxyanilino)methylidene]-2lambda~6~-thieno[3,2-c][1,2]thiazine-2,2,4(1H,3H)-trione
Chemical Structure Depiction of
1-[(4-chlorophenyl)methyl]-3-[(4-methoxyanilino)methylidene]-2lambda~6~-thieno[3,2-c][1,2]thiazine-2,2,4(1H,3H)-trione
1-[(4-chlorophenyl)methyl]-3-[(4-methoxyanilino)methylidene]-2lambda~6~-thieno[3,2-c][1,2]thiazine-2,2,4(1H,3H)-trione
Compound characteristics
| Compound ID: | E953-0213 |
| Compound Name: | 1-[(4-chlorophenyl)methyl]-3-[(4-methoxyanilino)methylidene]-2lambda~6~-thieno[3,2-c][1,2]thiazine-2,2,4(1H,3H)-trione |
| Molecular Weight: | 460.96 |
| Molecular Formula: | C21 H17 Cl N2 O4 S2 |
| Smiles: | COc1ccc(cc1)N/C=C1/C(c2c(ccs2)N(Cc2ccc(cc2)[Cl])S1(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6879 |
| logD: | 4.6879 |
| logSw: | -4.8056 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.072 |
| InChI Key: | XFCMPFKHKIIYGE-UHFFFAOYSA-N |