1-(prop-2-en-1-yl)-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one--hydrogen chloride (1/1)
Chemical Structure Depiction of
1-(prop-2-en-1-yl)-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one--hydrogen chloride (1/1)
1-(prop-2-en-1-yl)-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 8010-3030 |
| Compound Name: | 1-(prop-2-en-1-yl)-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one--hydrogen chloride (1/1) |
| Molecular Weight: | 238.71 |
| Molecular Formula: | C12 H14 N2 O |
| Salt: | HCl |
| Smiles: | C=CCN1C(CCNc2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8544 |
| logD: | 1.8542 |
| logSw: | -2.0834 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 27.7582 |
| InChI Key: | IBOMJXSXFSLPAB-UHFFFAOYSA-N |