N-{N'-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(3-methyl-1-propyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-3-(dimethylamino)benzamide
Chemical Structure Depiction of
N-{N'-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(3-methyl-1-propyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-3-(dimethylamino)benzamide
N-{N'-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(3-methyl-1-propyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-3-(dimethylamino)benzamide
Compound characteristics
| Compound ID: | F340-3667 |
| Compound Name: | N-{N'-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(3-methyl-1-propyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-3-(dimethylamino)benzamide |
| Molecular Weight: | 476.58 |
| Molecular Formula: | C26 H32 N6 O3 |
| Smiles: | CCCn1cc(CN\C(NC(c2cccc(c2)N(C)C)=O)=N/c2ccc3c(c2)OCCO3)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.8747 |
| logD: | 2.2514 |
| logSw: | -3.185 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.588 |
| InChI Key: | PZEQAXISLKYMIC-UHFFFAOYSA-N |