N-{[2-(4-tert-butylphenyl)-1,3-benzoxazol-5-yl]carbamothioyl}furan-2-carboxamide
Chemical Structure Depiction of
N-{[2-(4-tert-butylphenyl)-1,3-benzoxazol-5-yl]carbamothioyl}furan-2-carboxamide
N-{[2-(4-tert-butylphenyl)-1,3-benzoxazol-5-yl]carbamothioyl}furan-2-carboxamide
Compound characteristics
| Compound ID: | 3616-2237 |
| Compound Name: | N-{[2-(4-tert-butylphenyl)-1,3-benzoxazol-5-yl]carbamothioyl}furan-2-carboxamide |
| Molecular Weight: | 419.5 |
| Molecular Formula: | C23 H21 N3 O3 S |
| Smiles: | CC(C)(C)c1ccc(cc1)c1nc2cc(ccc2o1)NC(NC(c1ccco1)=O)=S |
| Stereo: | ACHIRAL |
| logP: | 5.9958 |
| logD: | 5.9955 |
| logSw: | -5.4967 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.628 |
| InChI Key: | WSSYGGJZPGUIND-UHFFFAOYSA-N |