1-(4-{[4-(3-fluorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]acetyl}-1,4-diazepan-1-yl)-2-(4-methoxyphenyl)ethan-1-one
Chemical Structure Depiction of
1-(4-{[4-(3-fluorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]acetyl}-1,4-diazepan-1-yl)-2-(4-methoxyphenyl)ethan-1-one
1-(4-{[4-(3-fluorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]acetyl}-1,4-diazepan-1-yl)-2-(4-methoxyphenyl)ethan-1-one
Compound characteristics
| Compound ID: | V025-3245 |
| Compound Name: | 1-(4-{[4-(3-fluorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]acetyl}-1,4-diazepan-1-yl)-2-(4-methoxyphenyl)ethan-1-one |
| Molecular Weight: | 521.65 |
| Molecular Formula: | C29 H32 F N3 O3 S |
| Salt: | not_available |
| Smiles: | COc1ccc(CC(N2CCCN(CC2)C(CN2CCc3c(ccs3)C2c2cccc(c2)F)=O)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0814 |
| logD: | 4.0589 |
| logSw: | -4.308 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 44.326 |
| InChI Key: | WJIXZFTUUVMGKC-GDLZYMKVSA-N |