N-{[3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}-1-benzofuran-2-carboxamide
Chemical Structure Depiction of
N-{[3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}-1-benzofuran-2-carboxamide
N-{[3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}-1-benzofuran-2-carboxamide
Compound characteristics
| Compound ID: | 4059-2101 |
| Compound Name: | N-{[3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}-1-benzofuran-2-carboxamide |
| Molecular Weight: | 427.48 |
| Molecular Formula: | C24 H17 N3 O3 S |
| Smiles: | Cc1ccc2c(c1)nc(c1cccc(c1)NC(NC(c1cc3ccccc3o1)=O)=S)o2 |
| Stereo: | ACHIRAL |
| logP: | 6.335 |
| logD: | 6.3347 |
| logSw: | -6.3511 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.343 |
| InChI Key: | IRCZHKMEPOXQFT-UHFFFAOYSA-N |