7-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(ethylsulfanyl)pyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one
Chemical Structure Depiction of
7-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(ethylsulfanyl)pyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one
7-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(ethylsulfanyl)pyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one
Compound characteristics
Compound ID: | Y020-3169 |
Compound Name: | 7-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(ethylsulfanyl)pyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one |
Molecular Weight: | 381.41 |
Molecular Formula: | C18 H15 N5 O3 S |
Smiles: | CCSc1nc2N=CC3=C(C=CN(C3=O)c3ccc4c(c3)OCCO4)n2n1 |
Stereo: | ACHIRAL |
logP: | 1.6023 |
logD: | 1.6023 |
logSw: | -2.4003 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 64.908 |
InChI Key: | UFGJYBFJJNVYAU-UHFFFAOYSA-N |