4-amino-N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-ethyl-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxamide
Chemical Structure Depiction of
4-amino-N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-ethyl-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxamide
4-amino-N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-ethyl-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxamide
Compound characteristics
Compound ID: | F128-0179 |
Compound Name: | 4-amino-N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-ethyl-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxamide |
Molecular Weight: | 337.42 |
Molecular Formula: | C14 H15 N3 O3 S2 |
Smiles: | CCN1C(=C(C(NCc2ccc3c(c2)OCO3)=O)SC1=S)N |
Stereo: | ACHIRAL |
logP: | 2.0187 |
logD: | 2.0187 |
logSw: | -2.7973 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 65.251 |
InChI Key: | ZTGJWUHGCGIEIZ-UHFFFAOYSA-N |