N-[(2H-1,3-benzodioxol-5-yl)methyl]-1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
Compound ID: | F993-0386 |
Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide |
Molecular Weight: | 373.39 |
Molecular Formula: | C17 H15 N3 O5 S |
Smiles: | CN1C(c2cc(C(NCc3ccc4c(c3)OCO4)=O)sc2N(C)C1=O)=O |
Stereo: | ACHIRAL |
logP: | 2.1842 |
logD: | 2.1842 |
logSw: | -3.1382 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 73.322 |
InChI Key: | WSRVWHIYBYYOCB-UHFFFAOYSA-N |