3-bromo-N-(butan-2-yl)-N-{2-oxo-2-[4-(phenoxymethyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]ethyl}benzamide
Chemical Structure Depiction of
3-bromo-N-(butan-2-yl)-N-{2-oxo-2-[4-(phenoxymethyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]ethyl}benzamide
3-bromo-N-(butan-2-yl)-N-{2-oxo-2-[4-(phenoxymethyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]ethyl}benzamide
Compound characteristics
| Compound ID: | V021-4880 |
| Compound Name: | 3-bromo-N-(butan-2-yl)-N-{2-oxo-2-[4-(phenoxymethyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]ethyl}benzamide |
| Molecular Weight: | 541.51 |
| Molecular Formula: | C27 H29 Br N2 O3 S |
| Smiles: | CCC(C)N(CC(N1CCc2c(ccs2)C1COc1ccccc1)=O)C(c1cccc(c1)[Br])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.1802 |
| logD: | 6.1802 |
| logSw: | -5.4924 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.614 |
| InChI Key: | ZWLSKLZEMYIMQJ-UHFFFAOYSA-N |