N-{[4-(5-chloro-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}furan-2-carboxamide
Chemical Structure Depiction of
N-{[4-(5-chloro-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}furan-2-carboxamide
N-{[4-(5-chloro-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}furan-2-carboxamide
Compound characteristics
| Compound ID: | 3616-1770 |
| Compound Name: | N-{[4-(5-chloro-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}furan-2-carboxamide |
| Molecular Weight: | 397.84 |
| Molecular Formula: | C19 H12 Cl N3 O3 S |
| Smiles: | c1cc(C(NC(Nc2ccc(cc2)c2nc3cc(ccc3o2)[Cl])=S)=O)oc1 |
| Stereo: | ACHIRAL |
| logP: | 4.6516 |
| logD: | 4.6514 |
| logSw: | -4.9394 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.628 |
| InChI Key: | GYTQEGGOWBNSNJ-UHFFFAOYSA-N |