CAS: 731806-69-2
Name: 6-amino-2-phenyl-3,10,11-triazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13),11-pentaen-9-one
SMILES:
C1=CC=C(C=C1)C2=C3C=NNC(=O)C4=C3C(=CC(=C4)N)N2Molecular Processing
Molecular formula
C16H12N4O
Molecular weight
276.3
Exact mass
276.1011
XLogP
2.49
TPSA
83.27
H-bond donors
3
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
21
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0
Molar refractivity
83.21
Supplementary Information
InChIKey: CRSYCFLQNTZJCV-UHFFFAOYSA-N
Synonyme
8-amino-2-phenyl-1,5-dihydro-[1,2]diazepino[4,5,6-cd]indol-6-oneSCHEMBL4773016CRSYCFLQNTZJCV-UHFFFAOYSA-NDB-333810731806-69-2
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