N-{[2-(3-chloro-4-methoxyphenyl)-1,3-benzoxazol-5-yl]carbamothioyl}furan-2-carboxamide
Chemical Structure Depiction of
N-{[2-(3-chloro-4-methoxyphenyl)-1,3-benzoxazol-5-yl]carbamothioyl}furan-2-carboxamide
N-{[2-(3-chloro-4-methoxyphenyl)-1,3-benzoxazol-5-yl]carbamothioyl}furan-2-carboxamide
Compound characteristics
| Compound ID: | 3616-2413 |
| Compound Name: | N-{[2-(3-chloro-4-methoxyphenyl)-1,3-benzoxazol-5-yl]carbamothioyl}furan-2-carboxamide |
| Molecular Weight: | 427.86 |
| Molecular Formula: | C20 H14 Cl N3 O4 S |
| Smiles: | COc1ccc(cc1[Cl])c1nc2cc(ccc2o1)NC(NC(c1ccco1)=O)=S |
| Stereo: | ACHIRAL |
| logP: | 4.4415 |
| logD: | 4.4412 |
| logSw: | -4.6564 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.259 |
| InChI Key: | SXLKXBZAAVZMNA-UHFFFAOYSA-N |