6-{4-[4-(2,5-dimethyl-1H-pyrrol-1-yl)benzoyl]-1,4-diazepan-1-yl}-2-phenylpyridazin-3(2H)-one
Chemical Structure Depiction of
6-{4-[4-(2,5-dimethyl-1H-pyrrol-1-yl)benzoyl]-1,4-diazepan-1-yl}-2-phenylpyridazin-3(2H)-one
6-{4-[4-(2,5-dimethyl-1H-pyrrol-1-yl)benzoyl]-1,4-diazepan-1-yl}-2-phenylpyridazin-3(2H)-one
Compound characteristics
| Compound ID: | F977-0572 |
| Compound Name: | 6-{4-[4-(2,5-dimethyl-1H-pyrrol-1-yl)benzoyl]-1,4-diazepan-1-yl}-2-phenylpyridazin-3(2H)-one |
| Molecular Weight: | 467.57 |
| Molecular Formula: | C28 H29 N5 O2 |
| Smiles: | Cc1ccc(C)n1c1ccc(cc1)C(N1CCCN(CC1)C1C=CC(N(c2ccccc2)N=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2501 |
| logD: | 3.2501 |
| logSw: | -3.2375 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 50.381 |
| InChI Key: | OSHWGYPDBAMIOM-UHFFFAOYSA-N |