N-(2,3-dichlorophenyl)-4-{[4-(3-fluorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]acetyl}-1,4-diazepane-1-carboxamide
Chemical Structure Depiction of
N-(2,3-dichlorophenyl)-4-{[4-(3-fluorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]acetyl}-1,4-diazepane-1-carboxamide
N-(2,3-dichlorophenyl)-4-{[4-(3-fluorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]acetyl}-1,4-diazepane-1-carboxamide
Compound characteristics
| Compound ID: | V025-3270 |
| Compound Name: | N-(2,3-dichlorophenyl)-4-{[4-(3-fluorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]acetyl}-1,4-diazepane-1-carboxamide |
| Molecular Weight: | 561.51 |
| Molecular Formula: | C27 H27 Cl2 F N4 O2 S |
| Salt: | not_available |
| Smiles: | C1CN(CCN(C1)C(Nc1cccc(c1[Cl])[Cl])=O)C(CN1CCc2c(ccs2)C1c1cccc(c1)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.5728 |
| logD: | 5.5497 |
| logSw: | -6.0429 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.432 |
| InChI Key: | OEJSWBAZQUPDEZ-AREMUKBSSA-N |