N-(4-{[(2,5-dimethoxyphenyl)methyl]carbamoyl}phenyl)-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide
Chemical Structure Depiction of
N-(4-{[(2,5-dimethoxyphenyl)methyl]carbamoyl}phenyl)-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide
N-(4-{[(2,5-dimethoxyphenyl)methyl]carbamoyl}phenyl)-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide
Compound characteristics
| Compound ID: | G217-0268 |
| Compound Name: | N-(4-{[(2,5-dimethoxyphenyl)methyl]carbamoyl}phenyl)-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide |
| Molecular Weight: | 459.54 |
| Molecular Formula: | C27 H29 N3 O4 |
| Smiles: | COc1ccc(c(CNC(c2ccc(cc2)NC(N2CCCCc3ccccc23)=O)=O)c1)OC |
| Stereo: | ACHIRAL |
| logP: | 5.0626 |
| logD: | 5.0625 |
| logSw: | -4.6059 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.291 |
| InChI Key: | LLIFFILYPQXARM-UHFFFAOYSA-N |