3-methyl-N-{[2-(pyridin-3-yl)-1,3-benzoxazol-5-yl]carbamothioyl}-1-benzofuran-2-carboxamide
Chemical Structure Depiction of
3-methyl-N-{[2-(pyridin-3-yl)-1,3-benzoxazol-5-yl]carbamothioyl}-1-benzofuran-2-carboxamide
3-methyl-N-{[2-(pyridin-3-yl)-1,3-benzoxazol-5-yl]carbamothioyl}-1-benzofuran-2-carboxamide
Compound characteristics
| Compound ID: | 4059-2300 |
| Compound Name: | 3-methyl-N-{[2-(pyridin-3-yl)-1,3-benzoxazol-5-yl]carbamothioyl}-1-benzofuran-2-carboxamide |
| Molecular Weight: | 428.47 |
| Molecular Formula: | C23 H16 N4 O3 S |
| Smiles: | Cc1c2ccccc2oc1C(NC(Nc1ccc2c(c1)nc(c1cccnc1)o2)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7453 |
| logD: | 4.7419 |
| logSw: | -4.5849 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.094 |
| InChI Key: | NACFRXVBMNSUCN-UHFFFAOYSA-N |