N-(1,3-benzothiazol-2-yl)-3-[(4-methylphenyl)methyl]-2-oxo-2,3-dihydro-1,3-benzoxazole-5-carboxamide
Chemical Structure Depiction of
N-(1,3-benzothiazol-2-yl)-3-[(4-methylphenyl)methyl]-2-oxo-2,3-dihydro-1,3-benzoxazole-5-carboxamide
N-(1,3-benzothiazol-2-yl)-3-[(4-methylphenyl)methyl]-2-oxo-2,3-dihydro-1,3-benzoxazole-5-carboxamide
Compound characteristics
Compound ID: | F601-0801 |
Compound Name: | N-(1,3-benzothiazol-2-yl)-3-[(4-methylphenyl)methyl]-2-oxo-2,3-dihydro-1,3-benzoxazole-5-carboxamide |
Molecular Weight: | 415.47 |
Molecular Formula: | C23 H17 N3 O3 S |
Smiles: | Cc1ccc(CN2C(=O)Oc3ccc(cc23)C(Nc2nc3ccccc3s2)=O)cc1 |
Stereo: | ACHIRAL |
logP: | 5.4179 |
logD: | 5.4177 |
logSw: | -5.3292 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 55.919 |
InChI Key: | YSNVDDNJSZPBMC-UHFFFAOYSA-N |