CC(C)CC(O)c1c(Cl)ncc2c1c(=O)n(CCCO[Si](C)(C)C(C)(C)C)c(=O)n2C
名称: 3-[3-[tert-butyl(dimethyl)silyl]oxypropyl]-6-chloro-5-(1-hydroxy-3-methylbutyl)-1-methylpyrido[3,4-d]pyrimidine-2,4-dione
SMILES: CC(C)CC(O)c1c(Cl)ncc2c1c(=O)n(CCCO[Si](C)(C)C(C)(C)C)c(=O)n2C

Molecular Processing

Molecular formula
C22H36ClN3O4Si
Molecular weight
470.09
Exact mass
469.2164
XLogP
4.24
TPSA
86.35
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
8
Heavy atoms
31
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.682
Molar refractivity
128.43

Supplementary Information

InChIKey: RWMHWZUYUBDTFP-UHFFFAOYSA-N
同義語
SCHEMBL17508416RWMHWZUYUBDTFP-UHFFFAOYSA-N3-(3-(tert-butyldimethylsilyloxy)propyl)-6-chloro-5-(1-hydroxy-3-methylbutyl)-1-methylpyrido[3,4-d]pyrimidine-2,4(1H,3H)-dione
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