1-[(4-methylphenyl)methyl]-3-({[(pyridin-3-yl)methyl]amino}methylidene)-2lambda~6~-thieno[3,2-c][1,2]thiazine-2,2,4(1H,3H)-trione
Chemical Structure Depiction of
1-[(4-methylphenyl)methyl]-3-({[(pyridin-3-yl)methyl]amino}methylidene)-2lambda~6~-thieno[3,2-c][1,2]thiazine-2,2,4(1H,3H)-trione
1-[(4-methylphenyl)methyl]-3-({[(pyridin-3-yl)methyl]amino}methylidene)-2lambda~6~-thieno[3,2-c][1,2]thiazine-2,2,4(1H,3H)-trione
Compound characteristics
| Compound ID: | E953-0135 |
| Compound Name: | 1-[(4-methylphenyl)methyl]-3-({[(pyridin-3-yl)methyl]amino}methylidene)-2lambda~6~-thieno[3,2-c][1,2]thiazine-2,2,4(1H,3H)-trione |
| Molecular Weight: | 425.53 |
| Molecular Formula: | C21 H19 N3 O3 S2 |
| Smiles: | Cc1ccc(CN2c3ccsc3C(/C(=C/NCc3cccnc3)S2(=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.3838 |
| logD: | 2.3833 |
| logSw: | -2.4173 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.577 |
| InChI Key: | RDAYQVBRBDEWSC-UHFFFAOYSA-N |