N-{4-[(2,6-dimethylpyrimidin-4-yl)sulfamoyl]phenyl}-4-fluorobenzamide

N-{4-[(2,6-dimethylpyrimidin-4-yl)sulfamoyl]phenyl}-4-fluorobenzamide

Formula: C19H17FN4O3S

SMILES: CC1=NC(C)=NC(NS(=O)(=O)C2=CC=C(NC(=O)C3=CC=C(F)C=C3)C=C2)=C1

IUPAC: N-{4-[(2,6-dimethylpyrimidin-4-yl)sulfamoyl]phenyl}-4-fluorobenzamide

InChI: InChI=1S/C19H17FN4O3S/c1-12-11-18(22-13(2)21-12)24-28(26,27)17-9-7-16(8-10-17)23-19(25)14-3-5-15(20)6-4-14/h3-11H,1-2H3,(H,23,25)(H,21,22,24)

Composition: C (56.99%), H (4.28%), F (4.74%), N (13.99%), O (11.99%), S (8.01%)

Molar Mass: 400.43

Atom Count: 45

Heavy Atom Count: 28

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	400.10053976
Formal Charge	0
FSP3	0.11
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
InChIKey	OBRRFIAOYWXTNI-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	104.83
Topological Polar Surface Area	101.05
Polarizability	39.26
Ring Count	3
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C19H17FN4O3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00