3-[(2,6-dichlorophenyl)methyl]-6-ethyl-6-methyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d][1,2,3]triazin-4-one
Chemical Structure Depiction of
3-[(2,6-dichlorophenyl)methyl]-6-ethyl-6-methyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d][1,2,3]triazin-4-one
3-[(2,6-dichlorophenyl)methyl]-6-ethyl-6-methyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d][1,2,3]triazin-4-one
Compound characteristics
| Compound ID: | 8016-5401 |
| Compound Name: | 3-[(2,6-dichlorophenyl)methyl]-6-ethyl-6-methyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d][1,2,3]triazin-4-one |
| Molecular Weight: | 410.32 |
| Molecular Formula: | C18 H17 Cl2 N3 O2 S |
| Smiles: | CCC1(C)Cc2c3C(N(Cc4c(cccc4[Cl])[Cl])N=Nc3sc2CO1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4327 |
| logD: | 5.4327 |
| logSw: | -6.1515 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.647 |
| InChI Key: | YBCWRVMBBWSBBG-SFHVURJKSA-N |