N-{[5-(1,3-benzoxazol-2-yl)-2-methoxyphenyl]carbamothioyl}-3,4,5-trimethoxybenzamide
Chemical Structure Depiction of
N-{[5-(1,3-benzoxazol-2-yl)-2-methoxyphenyl]carbamothioyl}-3,4,5-trimethoxybenzamide
N-{[5-(1,3-benzoxazol-2-yl)-2-methoxyphenyl]carbamothioyl}-3,4,5-trimethoxybenzamide
Compound characteristics
Compound ID: | 4671-0486 |
Compound Name: | N-{[5-(1,3-benzoxazol-2-yl)-2-methoxyphenyl]carbamothioyl}-3,4,5-trimethoxybenzamide |
Molecular Weight: | 493.54 |
Molecular Formula: | C25 H23 N3 O6 S |
Smiles: | COc1ccc(cc1NC(NC(c1cc(c(c(c1)OC)OC)OC)=O)=S)c1nc2ccccc2o1 |
Stereo: | ACHIRAL |
logP: | 4.7633 |
logD: | 4.7633 |
logSw: | -4.6595 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 79.961 |
InChI Key: | CLBVRUVCVFUBQX-UHFFFAOYSA-N |