N-{N'-(4-bromophenyl)-N-[(oxolan-2-yl)methyl]carbamimidoyl}-3,5-dimethoxybenzamide
Chemical Structure Depiction of
N-{N'-(4-bromophenyl)-N-[(oxolan-2-yl)methyl]carbamimidoyl}-3,5-dimethoxybenzamide
N-{N'-(4-bromophenyl)-N-[(oxolan-2-yl)methyl]carbamimidoyl}-3,5-dimethoxybenzamide
Compound characteristics
| Compound ID: | L088-0249 |
| Compound Name: | N-{N'-(4-bromophenyl)-N-[(oxolan-2-yl)methyl]carbamimidoyl}-3,5-dimethoxybenzamide |
| Molecular Weight: | 462.34 |
| Molecular Formula: | C21 H24 Br N3 O4 |
| Smiles: | COc1cc(cc(c1)OC)C(NC(/NCC1CCCO1)=N/c1ccc(cc1)[Br])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8116 |
| logD: | 3.8053 |
| logSw: | -4.0395 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.593 |
| InChI Key: | ZGRDCOILCFILRD-QGZVFWFLSA-N |