N-{3-[benzyl(methyl)carbamoyl]-4-[4-(3-fluorobenzoyl)-1,4-diazepan-1-yl]phenyl}thiophene-2-carboxamide
Chemical Structure Depiction of
N-{3-[benzyl(methyl)carbamoyl]-4-[4-(3-fluorobenzoyl)-1,4-diazepan-1-yl]phenyl}thiophene-2-carboxamide
N-{3-[benzyl(methyl)carbamoyl]-4-[4-(3-fluorobenzoyl)-1,4-diazepan-1-yl]phenyl}thiophene-2-carboxamide
Compound characteristics
| Compound ID: | V024-6813 |
| Compound Name: | N-{3-[benzyl(methyl)carbamoyl]-4-[4-(3-fluorobenzoyl)-1,4-diazepan-1-yl]phenyl}thiophene-2-carboxamide |
| Molecular Weight: | 570.69 |
| Molecular Formula: | C32 H31 F N4 O3 S |
| Salt: | not_available |
| Smiles: | CN(Cc1ccccc1)C(c1cc(ccc1N1CCCN(CC1)C(c1cccc(c1)F)=O)NC(c1cccs1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2024 |
| logD: | 5.2023 |
| logSw: | -5.0395 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.437 |
| InChI Key: | SPYYJUWOOLEWCV-UHFFFAOYSA-N |