CC1=CC2=C(C=C1Cl)N=C(NC2=O)CCl
CAS: 289686-83-5
Name: 7-chloro-2-(chloromethyl)-6-methyl-3H-quinazolin-4-one
SMILES: CC1=CC2=C(C=C1Cl)N=C(NC2=O)CCl

Molecular Processing

Molecular formula
C10H8Cl2N2O
Molecular weight
243.09
Exact mass
242.0014
XLogP
2.62
TPSA
45.75
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
15
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
61.67

Supplementary Information

InChIKey: IUBLKKBZPLTKII-UHFFFAOYSA-N
Synonyme
7-chloro-2-(chloromethyl)-6-methylquinazolin-4(3H)-one289686-83-57-CHLORO-2-(CHLOROMETHYL)-6-METHYL-3H-QUINAZOLIN-4-ONESCHEMBL65843847-chloro-2-(chloromethyl)-6-methyl-1H-quinazolin-4-oneIUBLKKBZPLTKII-UHFFFAOYSA-NCS-M1329MFCD12828614AKOS037649910CS-13869DB-2429097-Chloro-2-chloromethyl-6-methyl-3,4-dihydroquinazolin-4-one
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