2-amino-3-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-5,6,7,8-tetrahydroindolizine-1-carbonitrile
Chemical Structure Depiction of
2-amino-3-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-5,6,7,8-tetrahydroindolizine-1-carbonitrile
2-amino-3-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-5,6,7,8-tetrahydroindolizine-1-carbonitrile
Compound characteristics
Compound ID: | 8019-6444 |
Compound Name: | 2-amino-3-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-5,6,7,8-tetrahydroindolizine-1-carbonitrile |
Molecular Weight: | 323.35 |
Molecular Formula: | C18 H17 N3 O3 |
Smiles: | C1CCn2c(C1)c(C#N)c(c2C(c1ccc2c(c1)OCCO2)=O)N |
Stereo: | ACHIRAL |
logP: | 1.712 |
logD: | 1.712 |
logSw: | -2.2466 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 66.27 |
InChI Key: | JBGCKBVRUNNTEJ-UHFFFAOYSA-N |