N,N-diphenyl-2-{5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl}acetamide

N,N-diphenyl-2-{5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl}acetamide

Formula: C23H17N5OS

SMILES: O=C(CSC1=NC2=C(N=N1)C1=C(N2)C=CC=C1)N(C1=CC=CC=C1)C1=CC=CC=C1

IUPAC: N,N-diphenyl-2-{5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl}acetamide

InChI: InChI=1S/C23H17N5OS/c29-20(28(16-9-3-1-4-10-16)17-11-5-2-6-12-17)15-30-23-25-22-21(26-27-23)18-13-7-8-14-19(18)24-22/h1-14H,15H2,(H,24,25,27)

Composition: C (67.14%), H (4.16%), N (17.02%), O (3.89%), S (7.79%)

Molar Mass: 411.48

Atom Count: 47

Heavy Atom Count: 30

Properties

Properties

Common Names	N/A
Aromatic Ring Count	5
Asymmetric Atom Count	0
Exact Mass	411.115381361
Formal Charge	0
FSP3	0.04
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	DRXLWYSNFPSPMS-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	119.69
Topological Polar Surface Area	74.77
Polarizability	46.89
Ring Count	5
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C23H17N5OS		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00