[(16E)-10-oxo-18-thia-2,9-diazatetracyclo[9.7.0.0³,?.0¹²,¹?]octadeca-1(11),2,12(17)-trien-16-ylidene]amino acetate

[(16E)-10-oxo-18-thia-2,9-diazatetracyclo[9.7.0.0³,?.0¹²,¹?]octadeca-1(11),2,12(17)-trien-16-ylidene]amino acetate

Formula: C17H19N3O3S

SMILES: CC(=O)ON=C1/CCCC2=C1SC1=C2C(=O)N2CCCCCC2=N1

IUPAC: [(16E)-10-oxo-18-thia-2,9-diazatetracyclo[9.7.0.0³,?.0¹²,¹?]octadeca-1(11),2,12(17)-trien-16-ylidene]amino acetate

InChI: InChI=1S/C17H19N3O3S/c1-10(21)23-19-12-7-5-6-11-14-16(24-15(11)12)18-13-8-3-2-4-9-20(13)17(14)22/h2-9H2,1H3/b19-12+

Composition: C (59.11%), H (5.54%), N (12.17%), O (13.90%), S (9.28%)

Molar Mass: 345.42

Atom Count: 43

Heavy Atom Count: 24

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	345.114712658
Formal Charge	0
FSP3	0.53
Hetero Ring Count	3
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
InChIKey	XAWQKDDKFVQVNZ-XDHOZWIPSA-N
Lipinski's Rule of Five	1
Molar Refractivity	91.68
Topological Polar Surface Area	71.33
Polarizability	33.95
Ring Count	4
Rotatable Bond Count	2

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C17H19N3O3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00