N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-6-methoxy-2-oxo-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-6-methoxy-2-oxo-2H-1-benzopyran-3-carboxamide
N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-6-methoxy-2-oxo-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | 8004-9061 |
| Compound Name: | N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-6-methoxy-2-oxo-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 405.41 |
| Molecular Formula: | C22 H19 N3 O5 |
| Smiles: | CC1=C(C(N(c2ccccc2)N1C)=O)NC(C1=Cc2cc(ccc2OC1=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4588 |
| logD: | -0.374 |
| logSw: | -1.8164 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.176 |
| InChI Key: | ZGMCCWXYJUVZLT-UHFFFAOYSA-N |