tert-butyl 2-[(2,4,4-trimethylpentan-2-yl)amino]-4,5-dihydrospiro[[1,4]benzodiazepine-3,4'-piperidine]-1'-carboxylate--hydrogen chloride (1/1)
Chemical Structure Depiction of
tert-butyl 2-[(2,4,4-trimethylpentan-2-yl)amino]-4,5-dihydrospiro[[1,4]benzodiazepine-3,4'-piperidine]-1'-carboxylate--hydrogen chloride (1/1)
tert-butyl 2-[(2,4,4-trimethylpentan-2-yl)amino]-4,5-dihydrospiro[[1,4]benzodiazepine-3,4'-piperidine]-1'-carboxylate--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | H010-0199C |
| Compound Name: | tert-butyl 2-[(2,4,4-trimethylpentan-2-yl)amino]-4,5-dihydrospiro[[1,4]benzodiazepine-3,4'-piperidine]-1'-carboxylate--hydrogen chloride (1/1) |
| Molecular Weight: | 479.11 |
| Molecular Formula: | C26 H42 N4 O2 |
| Salt: | HCl |
| Smiles: | CC(C)(C)CC(C)(C)NC1C2(CCN(CC2)C(=O)OC(C)(C)C)NCc2ccccc2N=1 |
| Stereo: | ACHIRAL |
| logP: | 5.4682 |
| logD: | 4.544 |
| logSw: | -5.4305 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.066 |
| InChI Key: | DRIGWFDCTVIYSR-UHFFFAOYSA-N |