이름: (±)-trans-3-[5-(4-benzyloxy-phenyl)-6-butyl-pyridazin-3-yloxymethyl]-4-hydroxymethyl-pyrrolidine-1-carboxylic acid tert-butyl ester
SMILES:
CCCCc1nnc(OC[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2CO)cc1-c1ccc(OCc2ccccc2)cc1Molecular Processing
Molecular formula
C32H41N3O5
Molecular weight
547.7
Exact mass
547.3046
XLogP
5.92
TPSA
94.01
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
11
Heavy atoms
40
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.469
Molar refractivity
154.22
Supplementary Information
상세 정보 불러오는 중…
6개 반응에 참여→