N-{3-[benzyl(methyl)carbamoyl]-4-[4-(2-phenylbutanoyl)-1,4-diazepan-1-yl]phenyl}thiophene-2-carboxamide
Chemical Structure Depiction of
N-{3-[benzyl(methyl)carbamoyl]-4-[4-(2-phenylbutanoyl)-1,4-diazepan-1-yl]phenyl}thiophene-2-carboxamide
N-{3-[benzyl(methyl)carbamoyl]-4-[4-(2-phenylbutanoyl)-1,4-diazepan-1-yl]phenyl}thiophene-2-carboxamide
Compound characteristics
| Compound ID: | V026-9267 |
| Compound Name: | N-{3-[benzyl(methyl)carbamoyl]-4-[4-(2-phenylbutanoyl)-1,4-diazepan-1-yl]phenyl}thiophene-2-carboxamide |
| Molecular Weight: | 594.78 |
| Molecular Formula: | C35 H38 N4 O3 S |
| Salt: | not_available |
| Smiles: | CCC(C(N1CCCN(CC1)c1ccc(cc1C(N(C)Cc1ccccc1)=O)NC(c1cccs1)=O)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.3416 |
| logD: | 6.341 |
| logSw: | -5.5148 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.437 |
| InChI Key: | NTIBTGIJNWLGAX-GDLZYMKVSA-N |