이름: (4R,9aR)-6-chloro-7-ethoxy-4-methyl-3,4,9,9a-tetrahydro-1H-2,4a,5-triaza-fluorene-2-carboxylic acid tert-butyl ester
SMILES:
CCOc1cc2c(nc1Cl)N1[C@H](C2)CN(C(=O)OC(C)(C)C)C[C@H]1CMolecular Processing
Molecular formula
C18H26ClN3O3
Molecular weight
367.88
Exact mass
367.1663
XLogP
3.5
TPSA
54.9
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
25
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.667
Molar refractivity
97.66
Supplementary Information
상세 정보 불러오는 중…
2개 반응에 참여→