N-(cyclopropylmethyl)-3-[4-(phenoxyacetyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]propanamide
Chemical Structure Depiction of
N-(cyclopropylmethyl)-3-[4-(phenoxyacetyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]propanamide
N-(cyclopropylmethyl)-3-[4-(phenoxyacetyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]propanamide
Compound characteristics
| Compound ID: | S629-2026 |
| Compound Name: | N-(cyclopropylmethyl)-3-[4-(phenoxyacetyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]propanamide |
| Molecular Weight: | 408.5 |
| Molecular Formula: | C24 H28 N2 O4 |
| Smiles: | C(Cc1ccc2c(CN(CCO2)C(COc2ccccc2)=O)c1)C(NCC1CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8097 |
| logD: | 2.8097 |
| logSw: | -3.2701 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.526 |
| InChI Key: | VFSJICHISLECFS-UHFFFAOYSA-N |