N-(butan-2-yl)-N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)furan-2-carboxamide
Chemical Structure Depiction of
N-(butan-2-yl)-N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)furan-2-carboxamide
N-(butan-2-yl)-N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)furan-2-carboxamide
Compound characteristics
| Compound ID: | V021-1787 |
| Compound Name: | N-(butan-2-yl)-N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)furan-2-carboxamide |
| Molecular Weight: | 496.01 |
| Molecular Formula: | C26 H30 Cl N5 O3 |
| Smiles: | CCC(C)N(CC(N1CCCN(CC1)c1ccc(c2ccccc2[Cl])nn1)=O)C(c1ccco1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9008 |
| logD: | 3.8946 |
| logSw: | -4.2358 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 65.275 |
| InChI Key: | ANTHVZZXCOMCPM-IBGZPJMESA-N |