1-[(4-chlorophenyl)methyl]-3-({[(pyridin-2-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-chlorophenyl)methyl]-3-({[(pyridin-2-yl)methyl]amino}methylidene)-2lambda~6~-thieno[3,2-c][1,2]thiazine-2,2,4(1H,3H)-trione
1-[(4-chlorophenyl)methyl]-3-({[(pyridin-2-yl)methyl]amino}methylidene)-2lambda~6~-thieno[3,2-c][1,2]thiazine-2,2,4(1H,3H)-trione
Compound characteristics
| Compound ID: | E953-0224 |
| Compound Name: | 1-[(4-chlorophenyl)methyl]-3-({[(pyridin-2-yl)methyl]amino}methylidene)-2lambda~6~-thieno[3,2-c][1,2]thiazine-2,2,4(1H,3H)-trione |
| Molecular Weight: | 445.94 |
| Molecular Formula: | C20 H16 Cl N3 O3 S2 |
| Smiles: | C(c1ccccn1)N/C=C1/C(c2c(ccs2)N(Cc2ccc(cc2)[Cl])S1(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.897 |
| logD: | 2.8969 |
| logSw: | -3.5378 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.602 |
| InChI Key: | YGJRRDHRTITCGI-UHFFFAOYSA-N |