3-(4-tert-butylbenzenesulfonyl)-5-chloro-[1,2,3]triazolo[1,5-a]quinazoline

3-(4-tert-butylbenzenesulfonyl)-5-chloro-[1,2,3]triazolo[1,5-a]quinazoline

Formula: C19H17ClN4O2S

SMILES: CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)C1=C2N=C(Cl)C3=CC=CC=C3N2N=N1

IUPAC: 3-(4-tert-butylbenzenesulfonyl)-5-chloro-[1,2,3]triazolo[1,5-a]quinazoline

InChI: InChI=1S/C19H17ClN4O2S/c1-19(2,3)12-8-10-13(11-9-12)27(25,26)18-17-21-16(20)14-6-4-5-7-15(14)24(17)23-22-18/h4-11H,1-3H3

Composition: C (56.93%), H (4.27%), Cl (8.84%), N (13.98%), O (7.98%), S (8.00%)

Molar Mass: 400.88

Atom Count: 44

Heavy Atom Count: 27

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	400.0760747
Formal Charge	0
FSP3	0.21
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
InChIKey	YSPHUUZTZSPQNI-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	116.84
Topological Polar Surface Area	77.22
Polarizability	42.34
Ring Count	4
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C19H17ClN4O2S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00