(4-amino-3-phenyl-2-sulfanylidene-2,3-dihydro-1,3-thiazol-5-yl)(3,4-dihydroisoquinolin-2(1H)-yl)methanone
Chemical Structure Depiction of
(4-amino-3-phenyl-2-sulfanylidene-2,3-dihydro-1,3-thiazol-5-yl)(3,4-dihydroisoquinolin-2(1H)-yl)methanone
(4-amino-3-phenyl-2-sulfanylidene-2,3-dihydro-1,3-thiazol-5-yl)(3,4-dihydroisoquinolin-2(1H)-yl)methanone
Compound characteristics
| Compound ID: | K286-0136 |
| Compound Name: | (4-amino-3-phenyl-2-sulfanylidene-2,3-dihydro-1,3-thiazol-5-yl)(3,4-dihydroisoquinolin-2(1H)-yl)methanone |
| Molecular Weight: | 367.49 |
| Molecular Formula: | C19 H17 N3 O S2 |
| Smiles: | C1CN(Cc2ccccc12)C(C1=C(N)N(C(=S)S1)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2666 |
| logD: | 3.2666 |
| logSw: | -3.192 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 39.425 |
| InChI Key: | STBGSTMNAPGORE-UHFFFAOYSA-N |