1-[4-(2-methylbenzoyl)-1,4-diazepan-1-yl]-3-(4-phenyl-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl)propan-1-one
Chemical Structure Depiction of
1-[4-(2-methylbenzoyl)-1,4-diazepan-1-yl]-3-(4-phenyl-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl)propan-1-one
1-[4-(2-methylbenzoyl)-1,4-diazepan-1-yl]-3-(4-phenyl-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl)propan-1-one
Compound characteristics
| Compound ID: | V018-2087 |
| Compound Name: | 1-[4-(2-methylbenzoyl)-1,4-diazepan-1-yl]-3-(4-phenyl-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl)propan-1-one |
| Molecular Weight: | 487.66 |
| Molecular Formula: | C29 H33 N3 O2 S |
| Salt: | not_available |
| Smiles: | Cc1ccccc1C(N1CCCN(CC1)C(CCN1CCc2c(ccs2)C1c1ccccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3217 |
| logD: | 3.744 |
| logSw: | -4.2892 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.288 |
| InChI Key: | KXURGNWIFLIUAC-MUUNZHRXSA-N |