4-chloropyrido[3,4-d]pyrimidine

4-chloropyrido[3,4-d]pyrimidine

CAS: 51752-67-1

Formula: C7H4ClN3

SMILES: ClC1=NC=NC2=CN=CC=C12

IUPAC: 4-chloropyrido[3,4-d]pyrimidine

InChI: InChI=1S/C7H4ClN3/c8-7-5-1-2-9-3-6(5)10-4-11-7/h1-4H

Composition: C (50.78%), H (2.44%), Cl (21.41%), N (25.38%)

Molar Mass: 165.58

Atom Count: 15

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	165.0093748
Formal Charge	0
FSP3	0
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	UKTHPAHJCQLABU-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	42.51
Topological Polar Surface Area	38.67
Polarizability	17.1
Ring Count	2
Rotatable Bond Count	0

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