6-chloro-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-4-oxo-4H-1-benzopyran-2-carboxamide
Chemical Structure Depiction of
6-chloro-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-4-oxo-4H-1-benzopyran-2-carboxamide
6-chloro-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-4-oxo-4H-1-benzopyran-2-carboxamide
Compound characteristics
| Compound ID: | D103-0202 |
| Compound Name: | 6-chloro-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-4-oxo-4H-1-benzopyran-2-carboxamide |
| Molecular Weight: | 409.83 |
| Molecular Formula: | C21 H16 Cl N3 O4 |
| Smiles: | [H]N(C1=C(C)N(C)N(C1=O)c1ccccc1)C(C1=CC(c2cc(ccc2O1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4357 |
| logD: | 1.5279 |
| logSw: | -3.5828 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.529 |
| InChI Key: | ZNBMKMINIMEKHC-UHFFFAOYSA-N |