4-amino-3-benzyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxamide
Chemical Structure Depiction of
4-amino-3-benzyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxamide
4-amino-3-benzyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxamide
Compound characteristics
| Compound ID: | F128-0047 |
| Compound Name: | 4-amino-3-benzyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxamide |
| Molecular Weight: | 429.56 |
| Molecular Formula: | C21 H23 N3 O3 S2 |
| Smiles: | COc1ccc(CCNC(C2=C(N)N(Cc3ccccc3)C(=S)S2)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 2.8583 |
| logD: | 2.8583 |
| logSw: | -3.4087 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 63.242 |
| InChI Key: | ZHTBACKRHJQNGU-UHFFFAOYSA-N |