N-[3-(azepan-1-yl)propyl]-3-(4-methoxyphenyl)-5-methyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carboxamide
Chemical Structure Depiction of
N-[3-(azepan-1-yl)propyl]-3-(4-methoxyphenyl)-5-methyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carboxamide
N-[3-(azepan-1-yl)propyl]-3-(4-methoxyphenyl)-5-methyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carboxamide
Compound characteristics
| Compound ID: | C448-1049 |
| Compound Name: | N-[3-(azepan-1-yl)propyl]-3-(4-methoxyphenyl)-5-methyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carboxamide |
| Molecular Weight: | 487.6 |
| Molecular Formula: | C28 H33 N5 O3 |
| Smiles: | Cn1c2C(N(c3ccc(cc3)OC)N=C(C(NCCCN3CCCCCC3)=O)c2c2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5642 |
| logD: | 0.9935 |
| logSw: | -3.9432 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.083 |
| InChI Key: | CSRFJEQTIWEUNU-UHFFFAOYSA-N |