이름: methyl 4-[(cyclopentyl{4-[(5-oxo-2-phenyl-5,6-dihydro-4H-1,3,4-oxadiazin-4-yl)methyl]phenyl}acetyl)amino]-2-methyl-2,3-dihydro-1H-indene-2-carboxylate
SMILES:
COC(=O)C1(C)Cc2cccc(NC(=O)C(c3ccc(CN4N=C(c5ccccc5)OCC4=O)cc3)C3CCCC3)c2C1Molecular Processing
Molecular formula
C35H37N3O5
Molecular weight
579.7
Exact mass
579.2733
XLogP
5.6
TPSA
97.3
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
8
Heavy atoms
43
Rings
6
Aromatic rings
3
Saturated rings
1
Aliphatic rings
3
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.371
Molar refractivity
163.22
Supplementary Information
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