C1COCCN1C2=NC(=NC3=C2C=CC(=C3)C4=CC=C(O4)C=O)Cl
CAS: 1374208-55-5
Name: 5-(2-chloro-4-morpholin-4-ylquinazolin-7-yl)furan-2-carbaldehyde
SMILES: C1COCCN1C2=NC(=NC3=C2C=CC(=C3)C4=CC=C(O4)C=O)Cl

Molecular Processing

Molecular formula
C17H14ClN3O3
Molecular weight
343.77
Exact mass
343.0724
XLogP
3.19
TPSA
68.46
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
3
Heavy atoms
24
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.235
Molar refractivity
90.67

Supplementary Information

InChIKey: OKKCIMZOYASIGX-UHFFFAOYSA-N
Synonyme
1374208-55-55-(2-chloro-4-morpholino-quinazolin-7-yl)furan-2-carbaldehydeSCHEMBL2727144OKKCIMZOYASIGX-UHFFFAOYSA-NDA-45552
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