3-(4-methylphenyl)-N-[2-oxo-4-(propylamino)-2H-1-benzopyran-3-yl]-2,1-benzoxazole-5-carboxamide
Chemical Structure Depiction of
3-(4-methylphenyl)-N-[2-oxo-4-(propylamino)-2H-1-benzopyran-3-yl]-2,1-benzoxazole-5-carboxamide
3-(4-methylphenyl)-N-[2-oxo-4-(propylamino)-2H-1-benzopyran-3-yl]-2,1-benzoxazole-5-carboxamide
Compound characteristics
| Compound ID: | L150-0080 |
| Compound Name: | 3-(4-methylphenyl)-N-[2-oxo-4-(propylamino)-2H-1-benzopyran-3-yl]-2,1-benzoxazole-5-carboxamide |
| Molecular Weight: | 453.5 |
| Molecular Formula: | C27 H23 N3 O4 |
| Smiles: | CCCNC1=C(C(=O)Oc2ccccc12)NC(c1ccc2c(c1)c(c1ccc(C)cc1)on2)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0544 |
| logD: | 4.6215 |
| logSw: | -4.6365 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.48 |
| InChI Key: | AXOJXRZVYAMLHL-UHFFFAOYSA-N |