methyl {5-[3-(piperidin-1-yl)propanoyl]-10,11-dihydro-5H-dibenzo[b,f]azepin-3-yl}carbamate--hydrogen chloride (1/1)
Chemical Structure Depiction of
methyl {5-[3-(piperidin-1-yl)propanoyl]-10,11-dihydro-5H-dibenzo[b,f]azepin-3-yl}carbamate--hydrogen chloride (1/1)
methyl {5-[3-(piperidin-1-yl)propanoyl]-10,11-dihydro-5H-dibenzo[b,f]azepin-3-yl}carbamate--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | S008-0119 |
| Compound Name: | methyl {5-[3-(piperidin-1-yl)propanoyl]-10,11-dihydro-5H-dibenzo[b,f]azepin-3-yl}carbamate--hydrogen chloride (1/1) |
| Molecular Weight: | 443.97 |
| Molecular Formula: | C24 H29 N3 O3 |
| Salt: | HCl |
| Smiles: | COC(Nc1ccc2CCc3ccccc3N(C(CCN3CCCCC3)=O)c2c1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2248 |
| logD: | 3.7308 |
| logSw: | -4.1227 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.52 |
| InChI Key: | YKYOIFYOKHOTFI-UHFFFAOYSA-N |