N-[(4-chlorophenyl)methyl]-2-[(6-methyl-7-oxo-3-phenyl-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-[(4-chlorophenyl)methyl]-2-[(6-methyl-7-oxo-3-phenyl-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl)sulfanyl]acetamide
N-[(4-chlorophenyl)methyl]-2-[(6-methyl-7-oxo-3-phenyl-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | F143-0077 |
| Compound Name: | N-[(4-chlorophenyl)methyl]-2-[(6-methyl-7-oxo-3-phenyl-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl)sulfanyl]acetamide |
| Molecular Weight: | 489.04 |
| Molecular Formula: | C21 H17 Cl N4 O2 S3 |
| Smiles: | CN1C(=NC2=C(C1=O)SC(N2c1ccccc1)=S)SCC(NCc1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.685 |
| logD: | 3.685 |
| logSw: | -4.2307 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.075 |
| InChI Key: | WRIVDJMYDWWXAW-UHFFFAOYSA-N |