N-{[2-(2-chloro-5-iodophenyl)-1,3-benzoxazol-5-yl]carbamothioyl}furan-2-carboxamide
Chemical Structure Depiction of
N-{[2-(2-chloro-5-iodophenyl)-1,3-benzoxazol-5-yl]carbamothioyl}furan-2-carboxamide
N-{[2-(2-chloro-5-iodophenyl)-1,3-benzoxazol-5-yl]carbamothioyl}furan-2-carboxamide
Compound characteristics
| Compound ID: | 3616-4181 |
| Compound Name: | N-{[2-(2-chloro-5-iodophenyl)-1,3-benzoxazol-5-yl]carbamothioyl}furan-2-carboxamide |
| Molecular Weight: | 523.73 |
| Molecular Formula: | C19 H11 Cl I N3 O3 S |
| Smiles: | c1cc(C(NC(Nc2ccc3c(c2)nc(c2cc(ccc2[Cl])I)o3)=S)=O)oc1 |
| Stereo: | ACHIRAL |
| logP: | 6.2387 |
| logD: | 6.2385 |
| logSw: | -6.3918 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.628 |
| InChI Key: | KRFYNUQZRKSNGH-UHFFFAOYSA-N |