N-[(furan-2-yl)methyl]-2-methyl-N-{2-oxo-2-[4-(6-phenylpyridazin-3-yl)-1,4-diazepan-1-yl]ethyl}propanamide
Chemical Structure Depiction of
N-[(furan-2-yl)methyl]-2-methyl-N-{2-oxo-2-[4-(6-phenylpyridazin-3-yl)-1,4-diazepan-1-yl]ethyl}propanamide
N-[(furan-2-yl)methyl]-2-methyl-N-{2-oxo-2-[4-(6-phenylpyridazin-3-yl)-1,4-diazepan-1-yl]ethyl}propanamide
Compound characteristics
| Compound ID: | V026-0742 |
| Compound Name: | N-[(furan-2-yl)methyl]-2-methyl-N-{2-oxo-2-[4-(6-phenylpyridazin-3-yl)-1,4-diazepan-1-yl]ethyl}propanamide |
| Molecular Weight: | 461.56 |
| Molecular Formula: | C26 H31 N5 O3 |
| Smiles: | CC(C)C(N(CC(N1CCCN(CC1)c1ccc(c2ccccc2)nn1)=O)Cc1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3817 |
| logD: | 3.3756 |
| logSw: | -3.4734 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 65.117 |
| InChI Key: | BQXOBKNWUHFGQU-UHFFFAOYSA-N |