4-amino-N-butyl-3-(2-phenylethyl)-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxamide
Chemical Structure Depiction of
4-amino-N-butyl-3-(2-phenylethyl)-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxamide
4-amino-N-butyl-3-(2-phenylethyl)-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxamide
Compound characteristics
| Compound ID: | A0062636 |
| Compound Name: | 4-amino-N-butyl-3-(2-phenylethyl)-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxamide |
| Molecular Weight: | 335.49 |
| Molecular Formula: | C16 H21 N3 O S2 |
| Smiles: | CCCCNC(C1=C(N)N(CCc2ccccc2)C(=S)S1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3193 |
| logD: | 3.3193 |
| logSw: | -3.6131 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 48.231 |
| InChI Key: | YBGXSSQZVVNMRQ-UHFFFAOYSA-N |