N-(cyclopropylmethyl)-3-(2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)propanamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-(cyclopropylmethyl)-3-(2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)propanamide--hydrogen chloride (1/1)
N-(cyclopropylmethyl)-3-(2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)propanamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | S629-0009 |
| Compound Name: | N-(cyclopropylmethyl)-3-(2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)propanamide--hydrogen chloride (1/1) |
| Molecular Weight: | 310.82 |
| Molecular Formula: | C16 H22 N2 O2 |
| Salt: | HCl |
| Smiles: | C(Cc1ccc2c(CNCCO2)c1)C(NCC1CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6083 |
| logD: | -1.2911 |
| logSw: | -2.0049 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 45.056 |
| InChI Key: | JEGSBRBLNBWEAC-UHFFFAOYSA-N |