C1CC2=C(C1C3=CC=C(C=C3)F)N=C(N=C2Cl)Cl
CAS: 1263868-30-9
이름: 2,4-dichloro-7-(4-fluorophenyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine
SMILES: C1CC2=C(C1C3=CC=C(C=C3)F)N=C(N=C2Cl)Cl

Molecular Processing

Molecular formula
C13H9Cl2FN2
Molecular weight
283.13
Exact mass
282.0127
XLogP
4
TPSA
25.78
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
18
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.231
Molar refractivity
68.62

Supplementary Information

InChIKey: ATWGDJMSPINOIM-UHFFFAOYSA-N
동의어
2,4-DICHLORO-7-(4-FLUOROPHENYL)-6,7-DIHYDRO-5H-CYCLOPENTA[D]PYRIMIDINE1263868-30-9SCHEMBL360802ATWGDJMSPINOIM-UHFFFAOYSA-N2,4-dichloro-7-(4-fluorophenyl)-6,7-dihydro-5H cyclopenta[d]pyrimidine
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