N-({4-[5-(propan-2-yl)-1,3-benzoxazol-2-yl]phenyl}carbamothioyl)-1-benzofuran-2-carboxamide
Chemical Structure Depiction of
N-({4-[5-(propan-2-yl)-1,3-benzoxazol-2-yl]phenyl}carbamothioyl)-1-benzofuran-2-carboxamide
N-({4-[5-(propan-2-yl)-1,3-benzoxazol-2-yl]phenyl}carbamothioyl)-1-benzofuran-2-carboxamide
Compound characteristics
| Compound ID: | 4244-1346 |
| Compound Name: | N-({4-[5-(propan-2-yl)-1,3-benzoxazol-2-yl]phenyl}carbamothioyl)-1-benzofuran-2-carboxamide |
| Molecular Weight: | 455.53 |
| Molecular Formula: | C26 H21 N3 O3 S |
| Smiles: | CC(C)c1ccc2c(c1)nc(c1ccc(cc1)NC(NC(c1cc3ccccc3o1)=O)=S)o2 |
| Stereo: | ACHIRAL |
| logP: | 6.9571 |
| logD: | 6.9568 |
| logSw: | -6.3869 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.343 |
| InChI Key: | OPTQAPRKXMONOV-UHFFFAOYSA-N |