N-{4-[2-({3-[benzyl(ethyl)amino]propyl}amino)-2-oxoethyl]phenyl}-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide
Chemical Structure Depiction of
N-{4-[2-({3-[benzyl(ethyl)amino]propyl}amino)-2-oxoethyl]phenyl}-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide
N-{4-[2-({3-[benzyl(ethyl)amino]propyl}amino)-2-oxoethyl]phenyl}-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide
Compound characteristics
| Compound ID: | G217-1154 |
| Compound Name: | N-{4-[2-({3-[benzyl(ethyl)amino]propyl}amino)-2-oxoethyl]phenyl}-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide |
| Molecular Weight: | 498.67 |
| Molecular Formula: | C31 H38 N4 O2 |
| Smiles: | CCN(CCCNC(Cc1ccc(cc1)NC(N1CCCCc2ccccc12)=O)=O)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.937 |
| logD: | 3.2901 |
| logSw: | -4.3305 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.431 |
| InChI Key: | KBYISTXSFBQTHG-UHFFFAOYSA-N |