N-[(2-phenyl-1,3-benzoxazol-5-yl)carbamothioyl]thiophene-2-carboxamide
Chemical Structure Depiction of
N-[(2-phenyl-1,3-benzoxazol-5-yl)carbamothioyl]thiophene-2-carboxamide
N-[(2-phenyl-1,3-benzoxazol-5-yl)carbamothioyl]thiophene-2-carboxamide
Compound characteristics
| Compound ID: | 3820-5753 |
| Compound Name: | N-[(2-phenyl-1,3-benzoxazol-5-yl)carbamothioyl]thiophene-2-carboxamide |
| Molecular Weight: | 379.46 |
| Molecular Formula: | C19 H13 N3 O2 S2 |
| Smiles: | c1ccc(cc1)c1nc2cc(ccc2o1)NC(NC(c1cccs1)=O)=S |
| Stereo: | ACHIRAL |
| logP: | 4.7363 |
| logD: | 4.7362 |
| logSw: | -4.8006 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.068 |
| InChI Key: | SSYNTIAVOLYNKM-UHFFFAOYSA-N |