4-amino-N-benzyl-3-methyl-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxamide
Chemical Structure Depiction of
4-amino-N-benzyl-3-methyl-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxamide
4-amino-N-benzyl-3-methyl-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxamide
Compound characteristics
| Compound ID: | 8013-0109 |
| Compound Name: | 4-amino-N-benzyl-3-methyl-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxamide |
| Molecular Weight: | 279.38 |
| Molecular Formula: | C12 H13 N3 O S2 |
| Smiles: | CN1C(=C(C(NCc2ccccc2)=O)SC1=S)N |
| Stereo: | ACHIRAL |
| logP: | 1.5678 |
| logD: | 1.5678 |
| logSw: | -2.249 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 48.177 |
| InChI Key: | IJVWQJNUYZJSPG-UHFFFAOYSA-N |