2-[(3,4-dichlorophenoxy)methyl]-9,10-dihydro-8H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
2-[(3,4-dichlorophenoxy)methyl]-9,10-dihydro-8H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
2-[(3,4-dichlorophenoxy)methyl]-9,10-dihydro-8H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | Y502-0522 |
| Compound Name: | 2-[(3,4-dichlorophenoxy)methyl]-9,10-dihydro-8H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 391.28 |
| Molecular Formula: | C17 H12 Cl2 N4 O S |
| Smiles: | C1Cc2c3c4nc(COc5ccc(c(c5)[Cl])[Cl])nn4C=Nc3sc2C1 |
| Stereo: | ACHIRAL |
| logP: | 4.5528 |
| logD: | 4.5527 |
| logSw: | -4.8891 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 42.432 |
| InChI Key: | KXCOZVRSXFRDJA-UHFFFAOYSA-N |