N-[(furan-2-yl)methyl]-3-methyl-N-(2-{4-[6-(4-methylphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)butanamide
Chemical Structure Depiction of
N-[(furan-2-yl)methyl]-3-methyl-N-(2-{4-[6-(4-methylphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)butanamide
N-[(furan-2-yl)methyl]-3-methyl-N-(2-{4-[6-(4-methylphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)butanamide
Compound characteristics
| Compound ID: | V026-9814 |
| Compound Name: | N-[(furan-2-yl)methyl]-3-methyl-N-(2-{4-[6-(4-methylphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)butanamide |
| Molecular Weight: | 489.62 |
| Molecular Formula: | C28 H35 N5 O3 |
| Salt: | not_available |
| Smiles: | CC(C)CC(N(CC(N1CCCN(CC1)c1ccc(c2ccc(C)cc2)nn1)=O)Cc1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2709 |
| logD: | 4.2377 |
| logSw: | -4.1071 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 64.59 |
| InChI Key: | QTESNRCDKIROJO-UHFFFAOYSA-N |