2-methoxy-4-{[(4Z)-3-oxo-5-thia-2,7-diazatricyclo[6.4.0.0²,?]dodeca-1(12),6,8,10-tetraen-4-ylidene]methyl}phenyl acetate

2-methoxy-4-{[(4Z)-3-oxo-5-thia-2,7-diazatricyclo[6.4.0.0²,?]dodeca-1(12),6,8,10-tetraen-4-ylidene]methyl}phenyl acetate

Formula: C19H14N2O4S

SMILES: COC1=CC(C=C2/SC3=NC4=CC=CC=C4N3C2=O)=CC=C1OC(C)=O

IUPAC: 2-methoxy-4-{[(4Z)-3-oxo-5-thia-2,7-diazatricyclo[6.4.0.0²,?]dodeca-1(12),6,8,10-tetraen-4-ylidene]methyl}phenyl acetate

InChI: InChI=1S/C19H14N2O4S/c1-11(22)25-15-8-7-12(9-16(15)24-2)10-17-18(23)21-14-6-4-3-5-13(14)20-19(21)26-17/h3-10H,1-2H3/b17-10-

Composition: C (62.29%), H (3.85%), N (7.65%), O (17.47%), S (8.75%)

Molar Mass: 366.39

Atom Count: 40

Heavy Atom Count: 26

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	366.067428113
Formal Charge	0
FSP3	0.11
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	ZEGIWLHZEZJMJU-YVLHZVERSA-N
Lipinski's Rule of Five	1
Molar Refractivity	98.34
Topological Polar Surface Area	70.42
Polarizability	38.87
Ring Count	4
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C19H14N2O4S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00