1-(pyrrolidin-1-yl)propan-2-yl 3,5-di-tert-butylbenzoate--hydrogen chloride (1/1)
Chemical Structure Depiction of
1-(pyrrolidin-1-yl)propan-2-yl 3,5-di-tert-butylbenzoate--hydrogen chloride (1/1)
1-(pyrrolidin-1-yl)propan-2-yl 3,5-di-tert-butylbenzoate--hydrogen chloride (1/1)
Compound characteristics
Compound ID: | 5821-0114 |
Compound Name: | 1-(pyrrolidin-1-yl)propan-2-yl 3,5-di-tert-butylbenzoate--hydrogen chloride (1/1) |
Molecular Weight: | 381.99 |
Molecular Formula: | C22 H35 N O2 |
Salt: | HCl |
Smiles: | CC(CN1CCCC1)OC(c1cc(cc(c1)C(C)(C)C)C(C)(C)C)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 6.0121 |
logD: | 4.7389 |
logSw: | -5.3027 |
Hydrogen bond acceptors count: | 4 |
Polar surface area: | 24.6528 |
InChI Key: | YVDOBJABOBRJAQ-INIZCTEOSA-N |