N-{N'-(3,5-dimethylphenyl)-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-3,4-diethoxybenzamide
Chemical Structure Depiction of
N-{N'-(3,5-dimethylphenyl)-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-3,4-diethoxybenzamide
N-{N'-(3,5-dimethylphenyl)-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-3,4-diethoxybenzamide
Compound characteristics
| Compound ID: | F340-0610 |
| Compound Name: | N-{N'-(3,5-dimethylphenyl)-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-3,4-diethoxybenzamide |
| Molecular Weight: | 491.63 |
| Molecular Formula: | C28 H37 N5 O3 |
| Smiles: | CCn1c(C)c(CN\C(NC(c2ccc(c(c2)OCC)OCC)=O)=N/c2cc(C)cc(C)c2)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.2956 |
| logD: | 2.9772 |
| logSw: | -4.3008 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.55 |
| InChI Key: | HFGLMUCOEJWZFV-UHFFFAOYSA-N |