8-(cyclopropanecarbonyl)-7-phenyl-1,4,8-triazacycloundecan-5-one--hydrogen chloride (1/1)
Chemical Structure Depiction of
8-(cyclopropanecarbonyl)-7-phenyl-1,4,8-triazacycloundecan-5-one--hydrogen chloride (1/1)
8-(cyclopropanecarbonyl)-7-phenyl-1,4,8-triazacycloundecan-5-one--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | S791-0376 |
| Compound Name: | 8-(cyclopropanecarbonyl)-7-phenyl-1,4,8-triazacycloundecan-5-one--hydrogen chloride (1/1) |
| Molecular Weight: | 351.87 |
| Molecular Formula: | C18 H25 N3 O2 |
| Salt: | HCl |
| Smiles: | C1CNCCNC(CC(c2ccccc2)N(C1)C(C1CC1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.247 |
| logD: | -1.8847 |
| logSw: | -1.6263 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.147 |
| InChI Key: | WMKNKWOZRDUOGG-INIZCTEOSA-N |