N-{N'-(3,4-dimethoxyphenyl)-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-3,5-dimethylbenzamide
Chemical Structure Depiction of
N-{N'-(3,4-dimethoxyphenyl)-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-3,5-dimethylbenzamide
N-{N'-(3,4-dimethoxyphenyl)-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-3,5-dimethylbenzamide
Compound characteristics
| Compound ID: | F340-2017 |
| Compound Name: | N-{N'-(3,4-dimethoxyphenyl)-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-3,5-dimethylbenzamide |
| Molecular Weight: | 449.55 |
| Molecular Formula: | C25 H31 N5 O3 |
| Smiles: | Cc1cc(C)cc(c1)C(NC(/NCc1c(C)nn(C)c1C)=N/c1ccc(c(c1)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2764 |
| logD: | 2.352 |
| logSw: | -3.4917 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.952 |
| InChI Key: | ZQWGSYWUDRJARU-UHFFFAOYSA-N |