2-[4-(2-methylphenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]-1-{4-[(2RS)-2-phenylcyclopropane-1-carbonyl]-1,4-diazepan-1-yl}ethan-1-one
Chemical Structure Depiction of
2-[4-(2-methylphenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]-1-{4-[(2RS)-2-phenylcyclopropane-1-carbonyl]-1,4-diazepan-1-yl}ethan-1-one
2-[4-(2-methylphenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]-1-{4-[(2RS)-2-phenylcyclopropane-1-carbonyl]-1,4-diazepan-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | V024-9593 |
| Compound Name: | 2-[4-(2-methylphenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]-1-{4-[(2RS)-2-phenylcyclopropane-1-carbonyl]-1,4-diazepan-1-yl}ethan-1-one |
| Molecular Weight: | 513.7 |
| Molecular Formula: | C31 H35 N3 O2 S |
| Salt: | not_available |
| Smiles: | Cc1ccccc1C1c2ccsc2CCN1CC(N1CCCN(CC1)C(C1C[C@H]1c1ccccc1)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.0443 |
| logD: | 5.0194 |
| logSw: | -4.5485 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.561 |
| InChI Key: | YELNLGBGSDWOKL-WSEDSVFCSA-N |