N-[2-(3,4-dimethoxyphenyl)ethyl]-2-({4-[2,3-dimethyl-5-oxo-4-(propan-2-yl)-2,5-dihydro-1H-pyrazol-1-yl]benzene-1-sulfonyl}amino)benzamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-({4-[2,3-dimethyl-5-oxo-4-(propan-2-yl)-2,5-dihydro-1H-pyrazol-1-yl]benzene-1-sulfonyl}amino)benzamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-({4-[2,3-dimethyl-5-oxo-4-(propan-2-yl)-2,5-dihydro-1H-pyrazol-1-yl]benzene-1-sulfonyl}amino)benzamide
Compound characteristics
| Compound ID: | 8019-4068 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-2-({4-[2,3-dimethyl-5-oxo-4-(propan-2-yl)-2,5-dihydro-1H-pyrazol-1-yl]benzene-1-sulfonyl}amino)benzamide |
| Molecular Weight: | 592.71 |
| Molecular Formula: | C31 H36 N4 O6 S |
| Smiles: | CC(C)C1=C(C)N(C)N(C1=O)c1ccc(cc1)S(Nc1ccccc1C(NCCc1ccc(c(c1)OC)OC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9031 |
| logD: | 2.5522 |
| logSw: | -3.6812 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 99.888 |
| InChI Key: | IABKSZAQVSVQME-UHFFFAOYSA-N |