3-chloro-N-{N'-(3,4-dimethoxyphenyl)-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}benzamide
Chemical Structure Depiction of
3-chloro-N-{N'-(3,4-dimethoxyphenyl)-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}benzamide
3-chloro-N-{N'-(3,4-dimethoxyphenyl)-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}benzamide
Compound characteristics
| Compound ID: | F340-1552 |
| Compound Name: | 3-chloro-N-{N'-(3,4-dimethoxyphenyl)-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}benzamide |
| Molecular Weight: | 455.94 |
| Molecular Formula: | C23 H26 Cl N5 O3 |
| Smiles: | Cc1c(CN\C(NC(c2cccc(c2)[Cl])=O)=N/c2ccc(c(c2)OC)OC)c(C)n(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.089 |
| logD: | 2.1647 |
| logSw: | -3.6267 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.952 |
| InChI Key: | CVRKQUQCVFECPK-UHFFFAOYSA-N |