2-(chloromethyl)-10,10-dimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
2-(chloromethyl)-10,10-dimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
2-(chloromethyl)-10,10-dimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
Compound ID: | 8019-5937 |
Compound Name: | 2-(chloromethyl)-10,10-dimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine |
Molecular Weight: | 308.79 |
Molecular Formula: | C13 H13 Cl N4 O S |
Smiles: | CC1(C)Cc2c3c4nc(C[Cl])nn4C=Nc3sc2CO1 |
Stereo: | ACHIRAL |
logP: | 2.4507 |
logD: | 2.4507 |
logSw: | -2.5738 |
Hydrogen bond acceptors count: | 4 |
Polar surface area: | 42.535 |
InChI Key: | BRNMSZUWJVABAL-UHFFFAOYSA-N |