3-(4-chlorophenyl)-N-(3-{cyclopentyl[(furan-2-yl)methyl]amino}propyl)-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carboxamide
Chemical Structure Depiction of
3-(4-chlorophenyl)-N-(3-{cyclopentyl[(furan-2-yl)methyl]amino}propyl)-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carboxamide
3-(4-chlorophenyl)-N-(3-{cyclopentyl[(furan-2-yl)methyl]amino}propyl)-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carboxamide
Compound characteristics
| Compound ID: | E711-0171 |
| Compound Name: | 3-(4-chlorophenyl)-N-(3-{cyclopentyl[(furan-2-yl)methyl]amino}propyl)-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carboxamide |
| Molecular Weight: | 495.06 |
| Molecular Formula: | C28 H35 Cl N4 O2 |
| Smiles: | C1CCc2c(C(NCCCN(Cc3ccco3)C3CCCC3)=O)nc(c3ccc(cc3)[Cl])n2CC1 |
| Stereo: | ACHIRAL |
| logP: | 5.6774 |
| logD: | 4.3735 |
| logSw: | -6.1085 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.275 |
| InChI Key: | JQALVOVZRXQZSI-UHFFFAOYSA-N |