7-[(pyrrolidin-1-yl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepine--hydrogen chloride (1/2)
Chemical Structure Depiction of
7-[(pyrrolidin-1-yl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepine--hydrogen chloride (1/2)
7-[(pyrrolidin-1-yl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepine--hydrogen chloride (1/2)
Compound characteristics
| Compound ID: | T634-0151 |
| Compound Name: | 7-[(pyrrolidin-1-yl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepine--hydrogen chloride (1/2) |
| Molecular Weight: | 305.24 |
| Molecular Formula: | C14 H20 N2 O |
| Salt: | 2HCl |
| Smiles: | C1CCN(C1)Cc1ccc2c(CNCCO2)c1 |
| Stereo: | ACHIRAL |
| logP: | 1.59 |
| logD: | -0.6248 |
| logSw: | -2.0265 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 24.4316 |
| InChI Key: | AHIYQHNKUUPEGU-UHFFFAOYSA-N |