N-{[2-(3-bromophenyl)-1,3-benzoxazol-5-yl]carbamothioyl}furan-2-carboxamide
Chemical Structure Depiction of
N-{[2-(3-bromophenyl)-1,3-benzoxazol-5-yl]carbamothioyl}furan-2-carboxamide
N-{[2-(3-bromophenyl)-1,3-benzoxazol-5-yl]carbamothioyl}furan-2-carboxamide
Compound characteristics
| Compound ID: | 3616-2777 |
| Compound Name: | N-{[2-(3-bromophenyl)-1,3-benzoxazol-5-yl]carbamothioyl}furan-2-carboxamide |
| Molecular Weight: | 442.29 |
| Molecular Formula: | C19 H12 Br N3 O3 S |
| Smiles: | c1cc(cc(c1)[Br])c1nc2cc(ccc2o1)NC(NC(c1ccco1)=O)=S |
| Stereo: | ACHIRAL |
| logP: | 4.97 |
| logD: | 4.9697 |
| logSw: | -5.0046 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.628 |
| InChI Key: | NLJKOVOWXRJBRH-UHFFFAOYSA-N |