CAS: 313369-67-4
이름: 4-methyl-1,4,12-triazatetracyclo[7.6.1.05,16.010,15]hexadeca-5,7,9(16)-triene
SMILES:
CN1CCN2C3CCNCC3C4=C2C1=CC=C4Molecular Processing
Molecular formula
C14H19N3
Molecular weight
229.33
Exact mass
229.1579
XLogP
1.4
TPSA
18.51
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
0
Heavy atoms
17
Rings
4
Aromatic rings
1
Saturated rings
1
Aliphatic rings
3
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.571
Molar refractivity
71.07
Supplementary Information
InChIKey: QLGUCSLWLPCOTR-UHFFFAOYSA-N
동의어
3-methyl-2,3,6b,7,8,9,10,10a-octahydro-1H-pyrido[3',4':4,5]pyrrolo[1,2,3-de]quinoxaline313369-67-4SCHEMBL5507319SCHEMBL29360460QLGUCSLWLPCOTR-UHFFFAOYSA-N1H-Pyrido[3',4':4,5]pyrrolo[1,2,3-de]quinoxaline, 2,3,6b,7,8,9,10,10a-octahydro-3-methyl-, (6bR,10aS)-SB181774-methyl-1,4,12-triazatetracyclo[7.6.1.05,16.010,15]hexadeca-5,7,9(16)-triene(10R,15S)-4-methyl-1,4,12-triazatetracyclo[7.6.1.0,(1).0(1),(1)]hexadeca-5,7,9(16)-triene
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