CC(=O)N1CCN2C(=CC(=N2)NC3=CC(=CN(C3=O)C)Br)C1
CAS: 1346672-72-7
الاسم: 3-[(5-acetyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl)amino]-5-bromo-1-methylpyridin-2-one
SMILES: CC(=O)N1CCN2C(=CC(=N2)NC3=CC(=CN(C3=O)C)Br)C1

Molecular Processing

Molecular formula
C14H16BrN5O2
Molecular weight
366.22
Exact mass
365.0487
XLogP
1.45
TPSA
72.16
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
22
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.357
Molar refractivity
85.98

Supplementary Information

InChIKey: XFELGOWJIGMTJD-UHFFFAOYSA-N
مرادفات
SCHEMBL1392724XFELGOWJIGMTJD-UHFFFAOYSA-NDB-2119511346672-72-73-(5-acetyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-2-ylamino)-5-bromo-1-methylpyridin-2(1H)-one3-[(5-Acetyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-2-yl)amino]-5-bromo-1-methyl-2(1h)-pyridinone
عرض المصدر →
مشارك في 19 تفاعل→

بحث موسع

بحث البنية الفرعية→بحث التشابه→