N-{[5-(5-chloro-1,3-benzoxazol-2-yl)-2-methylphenyl]carbamothioyl}furan-2-carboxamide
Chemical Structure Depiction of
N-{[5-(5-chloro-1,3-benzoxazol-2-yl)-2-methylphenyl]carbamothioyl}furan-2-carboxamide
N-{[5-(5-chloro-1,3-benzoxazol-2-yl)-2-methylphenyl]carbamothioyl}furan-2-carboxamide
Compound characteristics
| Compound ID: | 3616-2072 |
| Compound Name: | N-{[5-(5-chloro-1,3-benzoxazol-2-yl)-2-methylphenyl]carbamothioyl}furan-2-carboxamide |
| Molecular Weight: | 411.86 |
| Molecular Formula: | C20 H14 Cl N3 O3 S |
| Smiles: | Cc1ccc(cc1NC(NC(c1ccco1)=O)=S)c1nc2cc(ccc2o1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.8947 |
| logD: | 4.8941 |
| logSw: | -4.9239 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.931 |
| InChI Key: | GKPDZCWCOWOUAT-UHFFFAOYSA-N |