In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 24th, 2011 | 19 | Yes |
Popular Name: methyl N-(cis)-1-benzyl-4-methylpiperidin-3-yl]carbamate hydrochloride methyl N-(cis)-1-benzyl-4-methyl…
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CAS Numbers: 694495-65-3 , 846043-59-2
cis-N-Benzyl-3-methoxycarbonylamino-4-methylpiperidine hydrochloride
Methyl N-(cis)-1-benzyl-4-methylpiperidin-3-yl]-carbamate hydrochloride
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 4.04 | 7.58 | -38.25 | 2 | 4 | 1 | 43 | 263.361 | 4 | ↓ |
Hi High (pH 8-9.5) | 4.04 | 5.06 | -6.07 | 1 | 4 | 0 | 42 | 262.353 | 4 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
melting_point | 2.070000000000000e+002 | KeyOrganics KeyOrganics |
MP | 207°(dec) | Matrix Scientific |
Purity | >95% | Matrix Scientific |
Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.