ethyl 7-(4-chlorophenyl)-2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carboxylate

ethyl 7-(4-chlorophenyl)-2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carboxylate

CAS: 338406-13-6

Formula: C18H17ClN2O2

SMILES: CCOC(=O)C1=C2N=C(C)C=C(C)N2C=C1C1=CC=C(Cl)C=C1

IUPAC: ethyl 7-(4-chlorophenyl)-2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carboxylate

InChI: InChI=1S/C18H17ClN2O2/c1-4-23-18(22)16-15(13-5-7-14(19)8-6-13)10-21-12(3)9-11(2)20-17(16)21/h5-10H,4H2,1-3H3

Composition: C (65.75%), H (5.21%), Cl (10.78%), N (8.52%), O (9.73%)

Molar Mass: 328.8

Atom Count: 40

Heavy Atom Count: 23

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	328.0978555
Formal Charge	0
FSP3	0.22
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	USCDFTMSISIPRM-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	92.39
Topological Polar Surface Area	43.6
Polarizability	35.89
Ring Count	3
Rotatable Bond Count	4

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95%	<2 Days	338406-13-6		$51.35-$524.40$51.35$63.37$86.31$524.40