N-[4-(2-{[2-(2-methoxyphenyl)ethyl]amino}-2-oxoethyl)phenyl]-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide
Chemical Structure Depiction of
N-[4-(2-{[2-(2-methoxyphenyl)ethyl]amino}-2-oxoethyl)phenyl]-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide
N-[4-(2-{[2-(2-methoxyphenyl)ethyl]amino}-2-oxoethyl)phenyl]-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide
Compound characteristics
| Compound ID: | G217-1254 |
| Compound Name: | N-[4-(2-{[2-(2-methoxyphenyl)ethyl]amino}-2-oxoethyl)phenyl]-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide |
| Molecular Weight: | 457.57 |
| Molecular Formula: | C28 H31 N3 O3 |
| Smiles: | COc1ccccc1CCNC(Cc1ccc(cc1)NC(N1CCCCc2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8084 |
| logD: | 4.8084 |
| logSw: | -4.4077 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.375 |
| InChI Key: | KNNIRCRONUHKTQ-UHFFFAOYSA-N |