N-[4-(2-{[(2,4-dimethoxyphenyl)methyl]amino}-2-oxoethyl)phenyl]-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide
Chemical Structure Depiction of
N-[4-(2-{[(2,4-dimethoxyphenyl)methyl]amino}-2-oxoethyl)phenyl]-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide
N-[4-(2-{[(2,4-dimethoxyphenyl)methyl]amino}-2-oxoethyl)phenyl]-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide
Compound characteristics
| Compound ID: | G217-1241 |
| Compound Name: | N-[4-(2-{[(2,4-dimethoxyphenyl)methyl]amino}-2-oxoethyl)phenyl]-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide |
| Molecular Weight: | 473.57 |
| Molecular Formula: | C28 H31 N3 O4 |
| Smiles: | COc1ccc(CNC(Cc2ccc(cc2)NC(N2CCCCc3ccccc23)=O)=O)c(c1)OC |
| Stereo: | ACHIRAL |
| logP: | 4.9675 |
| logD: | 4.9675 |
| logSw: | -4.5405 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.077 |
| InChI Key: | CNGCDOLTHKWNKU-UHFFFAOYSA-N |