(Z)-N'-(2-chlorophenyl)-N-(4,6-dimethyl-1H-pyrimidin-2-ylidene)-N''-(4-methylbenzenesulfonyl)guanidine

(Z)-N'-(2-chlorophenyl)-N-(4,6-dimethyl-1H-pyrimidin-2-ylidene)-N''-(4-methylbenzenesulfonyl)guanidine

Formula: C20H20ClN5O2S

SMILES: CC1=CC(C)=NC(N1)=NC(NC1=CC=CC=C1Cl)=N/S(=O)(=O)C1=CC=C(C)C=C1

IUPAC: (Z)-N'-(2-chlorophenyl)-N-(4,6-dimethyl-1,2-dihydropyrimidin-2-ylidene)-N''-(4-methylbenzenesulfonyl)guanidine

InChI: InChI=1S/C20H20ClN5O2S/c1-13-8-10-16(11-9-13)29(27,28)26-20(24-18-7-5-4-6-17(18)21)25-19-22-14(2)12-15(3)23-19/h4-12H,1-3H3,(H2,22,23,24,25,26)

Composition: C (55.88%), H (4.69%), Cl (8.25%), N (16.29%), O (7.44%), S (7.46%)

Molar Mass: 429.92

Atom Count: 49

Heavy Atom Count: 29

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	429.1026238
Formal Charge	0
FSP3	0.15
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	2
InChIKey	ZEZBPBINNWCALZ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	117.35
Topological Polar Surface Area	95.28
Polarizability	44.08
Ring Count	3
Rotatable Bond Count	2

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C20H20ClN5O2S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00