N-{4-[2-({2-[butyl(ethyl)amino]ethyl}amino)-2-oxoethyl]phenyl}-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide
Chemical Structure Depiction of
N-{4-[2-({2-[butyl(ethyl)amino]ethyl}amino)-2-oxoethyl]phenyl}-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide
N-{4-[2-({2-[butyl(ethyl)amino]ethyl}amino)-2-oxoethyl]phenyl}-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide
Compound characteristics
Compound ID: | G217-1153 |
Compound Name: | N-{4-[2-({2-[butyl(ethyl)amino]ethyl}amino)-2-oxoethyl]phenyl}-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide |
Molecular Weight: | 450.62 |
Molecular Formula: | C27 H38 N4 O2 |
Smiles: | CCCCN(CC)CCNC(Cc1ccc(cc1)NC(N1CCCCc2ccccc12)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.6254 |
logD: | 2.7373 |
logSw: | -4.0041 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 52.681 |
InChI Key: | IFULMOHKPKLORK-UHFFFAOYSA-N |