C1CC1CN2C3=CC(=C(C=C3C(=O)N(C2=O)N(CC4=CC=CC=C4)CC5=CC=CC=C5)F)F
Name: 1-(cyclopropylmethyl)-3-(dibenzylamino)-6,7-difluoroquinazoline-2,4-dione
SMILES: C1CC1CN2C3=CC(=C(C=C3C(=O)N(C2=O)N(CC4=CC=CC=C4)CC5=CC=CC=C5)F)F

Molecular Processing

Molecular formula
C26H23F2N3O2
Molecular weight
447.49
Exact mass
447.1758
XLogP
4.19
TPSA
47.24
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
7
Heavy atoms
33
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.231
Molar refractivity
123.62

Supplementary Information

InChIKey: FVRSGQOZJYBPQI-UHFFFAOYSA-N
Synonyme
SCHEMBL4520423FVRSGQOZJYBPQI-UHFFFAOYSA-N3-Dibenzylamino-6,7-difluoro-1-cyclopropylmethyl-1H-quinazoline 2,4-dione3-Dibenzylamino-6,7-difluoro-1-cyclopropylmethyl-1H-quinazoline-2,4-dione
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