4-amino-N~5~-cycloheptyl-N~3~-[(3-methoxyphenyl)methyl]-1,2-thiazole-3,5-dicarboxamide
Chemical Structure Depiction of
4-amino-N~5~-cycloheptyl-N~3~-[(3-methoxyphenyl)methyl]-1,2-thiazole-3,5-dicarboxamide
4-amino-N~5~-cycloheptyl-N~3~-[(3-methoxyphenyl)methyl]-1,2-thiazole-3,5-dicarboxamide
Compound characteristics
| Compound ID: | M050-0953 |
| Compound Name: | 4-amino-N~5~-cycloheptyl-N~3~-[(3-methoxyphenyl)methyl]-1,2-thiazole-3,5-dicarboxamide |
| Molecular Weight: | 402.51 |
| Molecular Formula: | C20 H26 N4 O3 S |
| Smiles: | COc1cccc(CNC(c2c(c(C(NC3CCCCCC3)=O)sn2)N)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.3997 |
| logD: | 3.3997 |
| logSw: | -3.9337 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 87.313 |
| InChI Key: | AUTRFSCBRYGBGA-UHFFFAOYSA-N |