N-{[4-chloro-3-(5,6-dimethyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}furan-2-carboxamide
Chemical Structure Depiction of
N-{[4-chloro-3-(5,6-dimethyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}furan-2-carboxamide
N-{[4-chloro-3-(5,6-dimethyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}furan-2-carboxamide
Compound characteristics
| Compound ID: | 3616-2355 |
| Compound Name: | N-{[4-chloro-3-(5,6-dimethyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}furan-2-carboxamide |
| Molecular Weight: | 425.89 |
| Molecular Formula: | C21 H16 Cl N3 O3 S |
| Smiles: | Cc1cc2c(cc1C)oc(c1cc(ccc1[Cl])NC(NC(c1ccco1)=O)=S)n2 |
| Stereo: | ACHIRAL |
| logP: | 5.7213 |
| logD: | 5.7211 |
| logSw: | -6.0139 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.628 |
| InChI Key: | LEMQKRZFUAEZKC-UHFFFAOYSA-N |