2-[(4-methylphenoxy)methyl]-9,10,11,12-tetrahydro-8H-cyclohepta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
2-[(4-methylphenoxy)methyl]-9,10,11,12-tetrahydro-8H-cyclohepta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
2-[(4-methylphenoxy)methyl]-9,10,11,12-tetrahydro-8H-cyclohepta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | 4072-2805 |
| Compound Name: | 2-[(4-methylphenoxy)methyl]-9,10,11,12-tetrahydro-8H-cyclohepta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 364.47 |
| Molecular Formula: | C20 H20 N4 O S |
| Smiles: | Cc1ccc(cc1)OCc1nc2c3c4CCCCCc4sc3N=Cn2n1 |
| Stereo: | ACHIRAL |
| logP: | 4.5484 |
| logD: | 4.5467 |
| logSw: | -4.5294 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 42.397 |
| InChI Key: | BNWKGUQTXOSWFR-UHFFFAOYSA-N |