4-chloro-3,5-bis(3,4-dimethoxyphenyl)-1H-pyrazole

4-chloro-3,5-bis(3,4-dimethoxyphenyl)-1H-pyrazole

CAS: 1159988-73-4

Formula: C19H19ClN2O4

SMILES: COC1=CC=C(C=C1OC)C1=C(Cl)C(=NN1)C1=CC=C(OC)C(OC)=C1

IUPAC: 4-chloro-3,5-bis(3,4-dimethoxyphenyl)-1H-pyrazole

InChI: InChI=1S/C19H19ClN2O4/c1-23-13-7-5-11(9-15(13)25-3)18-17(20)19(22-21-18)12-6-8-14(24-2)16(10-12)26-4/h5-10H,1-4H3,(H,21,22)

Composition: C (60.88%), H (5.11%), Cl (9.46%), N (7.47%), O (17.07%)

Molar Mass: 374.82

Atom Count: 45

Heavy Atom Count: 26

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	374.1033348
Formal Charge	0
FSP3	0.21
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
InChIKey	ORNMEMRMEZYWFE-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	100.18
Topological Polar Surface Area	65.6
Polarizability	41
Ring Count	3
Rotatable Bond Count	6

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