3-[(4-methylphenyl)methyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d][1,2,3]triazin-4(3H)-one
Chemical Structure Depiction of
3-[(4-methylphenyl)methyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d][1,2,3]triazin-4(3H)-one
3-[(4-methylphenyl)methyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d][1,2,3]triazin-4(3H)-one
Compound characteristics
| Compound ID: | 6197-5920 |
| Compound Name: | 3-[(4-methylphenyl)methyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d][1,2,3]triazin-4(3H)-one |
| Molecular Weight: | 311.4 |
| Molecular Formula: | C17 H17 N3 O S |
| Smiles: | Cc1ccc(CN2C(c3c4CCCCc4sc3N=N2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.3795 |
| logD: | 4.3795 |
| logSw: | -4.4772 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 40.756 |
| InChI Key: | HJKFQUOBAIOXBT-UHFFFAOYSA-N |