CAS: 262444-48-4
Name: 4-chloro-7-(1,4-dioxaspiro[4.5]decan-8-yl)-5-iodopyrrolo[2,3-d]pyrimidine
SMILES:
C1CC2(CCC1N3C=C(C4=C3N=CN=C4Cl)I)OCCO2Molecular Processing
Molecular formula
C14H15ClIN3O2
Molecular weight
419.65
Exact mass
418.9898
XLogP
3.55
TPSA
49.17
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
21
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.571
Molar refractivity
87.4
Supplementary Information
InChIKey: IJQRMNNJDXVVMM-UHFFFAOYSA-N
Synonyme
4-chloro-5-iodo-7-(1,4-dioxaspiro[4.5]decan-8-yl)-7H-pyrrolo[2,3-d]pyrimidine262444-48-4MFCD230991454-chloro-7-(1,4-dioxaspiro[4.5]decan-8-yl)-5-iodopyrrolo[2,3-d]pyrimidine4-chloro-7-{1,4-dioxaspiro[4.5]decan-8-yl}-5-iodo-7H-pyrrolo[2,3-d]pyrimidine4-chloro-7-(1,4-dioxaspiro[4.5]decan-8-yl)-5-iodo-7H-pyrrolo[2,3-d]pyrimidineC14H15ClIN3O2SCHEMBL1443178IJQRMNNJDXVVMM-UHFFFAOYSA-NAKOS037647385AS-73492DB-332190W158004-chloro-7-(1,4-dioxa-spiro[4.5]dec-8-yl)-5-iodo-7H-pyrrolo[2,3-d]pyrimidine4-chloro-7-(1,4-dioxaspiro[4.5]dec-8-yl)-5-iodo-7H-pyrrolo[2,3-d]pyrimidine4-chloro-7-(1,4-dioxaspiro[4.5]decan-8-yl)-5-iodo-pyrrolo[2,3-d]pyrimidine
An 6 Reaktionen beteiligt→