N1,N2-bis(pyrimidin-2-yl)cyclohex-4-ene-1,2-dicarboxamide

N1,N2-bis(pyrimidin-2-yl)cyclohex-4-ene-1,2-dicarboxamide

CAS: 478033-98-6

Formula: C16H16N6O2

SMILES: O=C(NC1=NC=CC=N1)C1CC=CCC1C(=O)NC1=NC=CC=N1

IUPAC: N1,N2-bis(pyrimidin-2-yl)cyclohex-4-ene-1,2-dicarboxamide

InChI: InChI=1/C16H16N6O2/c23-13(21-15-17-7-3-8-18-15)11-5-1-2-6-12(11)14(24)22-16-19-9-4-10-20-16/h1-4,7-12H,5-6H2,(H,17,18,21,23)(H,19,20,22,24)

Composition: C (59.25%), H (4.97%), N (25.91%), O (9.87%)

Molar Mass: 324.344

Atom Count: 40

Heavy Atom Count: 24

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	2
Exact Mass	324.133473779
Formal Charge	0
FSP3	0.25
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	2
InChIKey	JWINSKBVHSGJFT-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	90.98
Topological Polar Surface Area	109.76
Polarizability	32.56
Ring Count	3
Rotatable Bond Count	4

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