名称: methyl 19-cyclohexyl-10-methylidene-8-oxa-12-azatetracyclo[10.7.0.02,7.013,18]nonadeca-1(19),2,4,6,13(18),14,16-heptaene-15-carboxylate
SMILES:
COC(=O)C1=CC2=C(C=C1)C(=C3N2CC(=C)COC4=CC=CC=C43)C5CCCCC5Molecular Processing
Molecular formula
C26H27NO3
Molecular weight
401.51
Exact mass
401.1991
XLogP
6.09
TPSA
40.46
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
30
Rings
5
Aromatic rings
3
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.346
Molar refractivity
119.17
Supplementary Information
InChIKey: DTCISARTIAMUDL-UHFFFAOYSA-N
同義語
SCHEMBL393074DTCISARTIAMUDL-UHFFFAOYSA-Nmethyl 14-cyclohexyl-7-methylene-7,8-dihydro-6H-indolo[1,2-e][1,5]benzoxazocine-11-carboxylate
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