N,N-dimethyl-4-{[(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]amino}benzene-1-sulfonamide
Chemical Structure Depiction of
N,N-dimethyl-4-{[(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]amino}benzene-1-sulfonamide
N,N-dimethyl-4-{[(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]amino}benzene-1-sulfonamide
Compound characteristics
| Compound ID: | Y501-4001 |
| Compound Name: | N,N-dimethyl-4-{[(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]amino}benzene-1-sulfonamide |
| Molecular Weight: | 384.46 |
| Molecular Formula: | C19 H20 N4 O3 S |
| Smiles: | CC1/C(=C/Nc2ccc(cc2)S(N(C)C)(=O)=O)C(N(c2ccccc2)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.488 |
| logD: | 2.4846 |
| logSw: | -2.783 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.851 |
| InChI Key: | OCPLRNVMPPRMSM-UHFFFAOYSA-N |