4-amino-N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(5-chloro-2-methoxyphenyl)-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-(5-chloro-2-methoxyphenyl)-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxamide
4-amino-N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(5-chloro-2-methoxyphenyl)-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxamide
Compound characteristics
| Compound ID: | F128-0125 |
| Compound Name: | 4-amino-N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(5-chloro-2-methoxyphenyl)-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxamide |
| Molecular Weight: | 449.93 |
| Molecular Formula: | C19 H16 Cl N3 O4 S2 |
| Smiles: | COc1ccc(cc1N1C(=C(C(NCc2ccc3c(c2)OCO3)=O)SC1=S)N)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.3063 |
| logD: | 3.3063 |
| logSw: | -3.7731 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 71.973 |
| InChI Key: | QKYIVASDJCMICY-UHFFFAOYSA-N |