2-methyl-N-{2-oxo-2-[4-(6-phenylpyridazin-3-yl)-1,4-diazepan-1-yl]ethyl}-N-(prop-2-en-1-yl)benzamide
Chemical Structure Depiction of
2-methyl-N-{2-oxo-2-[4-(6-phenylpyridazin-3-yl)-1,4-diazepan-1-yl]ethyl}-N-(prop-2-en-1-yl)benzamide
2-methyl-N-{2-oxo-2-[4-(6-phenylpyridazin-3-yl)-1,4-diazepan-1-yl]ethyl}-N-(prop-2-en-1-yl)benzamide
Compound characteristics
| Compound ID: | V017-8376 |
| Compound Name: | 2-methyl-N-{2-oxo-2-[4-(6-phenylpyridazin-3-yl)-1,4-diazepan-1-yl]ethyl}-N-(prop-2-en-1-yl)benzamide |
| Molecular Weight: | 469.59 |
| Molecular Formula: | C28 H31 N5 O2 |
| Smiles: | Cc1ccccc1C(N(CC=C)CC(N1CCCN(CC1)c1ccc(c2ccccc2)nn1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7826 |
| logD: | 3.7765 |
| logSw: | -3.8402 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 57.347 |
| InChI Key: | ZECBYLXTXTVMSI-UHFFFAOYSA-N |