CN1CCN(c2ccc(B3OC(C)(C)C(C)(C)O3)cn2)CC1
CAS: 918524-63-7
Nom: 1-methyl-4-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]piperazine
SMILES: CN1CCN(c2ccc(B3OC(C)(C)C(C)(C)O3)cn2)CC1

Molecular Processing

Molecular formula
C16H26BN3O2
Molecular weight
303.22
Exact mass
303.2118
XLogP
1.13
TPSA
37.83
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
22
Rings
3
Aromatic rings
1
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.688
Molar refractivity
89.66

Supplementary Information

InChIKey: KVQXFNGVIIPCSX-UHFFFAOYSA-N
Synonymes
918524-63-71-Methyl-4-(5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl)piperazine1-methyl-4-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]piperazineDTXSID50377794RefChem:231844DTXCID50328822674-539-02-(4-methylpiperazin-1-yl)pyridine-5-boronic acid pinacol esterMFCD074379952-(4-methyl-piperazin-1-yl)pyridine-5-boronic acid pinacol ester2-(4-METHYLPIPERAZINO)PYRIDINE-5-BORONIC ACID PINACOL ESTER1-methyl-4-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridyl]piperazine6-(4-Methyl-1-piperazinyl)pyridine-3-boronic Acid Pinacol Ester1-methyl-4-[5-(tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]piperazine1-methyl-4-[5-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)pyridin-2-yl]piperazine1-methyl-4-(5-(4,4,5,5-tetramethyl-1,3,2-dioxa-borolan-2-yl)pyridin-2-yl)piperazineKVQXFNGVIIPCSX-UHFFFAOYSA-N1-methyl-4-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]piperazineSCHEMBL578540SCHEMBL29542633EX-A3896HIB11409(6-(4-METHYLPIPERAZIN-1-YL)PYRIDIN-3-YL)BORONIC ACID PINACOL ESTERAKOS015960103AB41978AS-2719CS-W0070501-methyl-4-[5-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-pyridin-2-yl]-piperazineAC-30411SY025292
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