5-({3-methoxy-4-[(3-methylphenyl)methoxy]phenyl}methylidene)-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione

5-({3-methoxy-4-[(3-methylphenyl)methoxy]phenyl}methylidene)-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione

Formula: C22H22N2O4S

SMILES: COC1=CC(C=C2C(=O)N(C)C(=S)N(C)C2=O)=CC=C1OCC1=CC=CC(C)=C1

IUPAC: 5-({3-methoxy-4-[(3-methylphenyl)methoxy]phenyl}methylidene)-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione

InChI: InChI=1S/C22H22N2O4S/c1-14-6-5-7-16(10-14)13-28-18-9-8-15(12-19(18)27-4)11-17-20(25)23(2)22(29)24(3)21(17)26/h5-12H,13H2,1-4H3

Composition: C (64.37%), H (5.40%), N (6.82%), O (15.59%), S (7.81%)

Molar Mass: 410.49

Atom Count: 51

Heavy Atom Count: 29

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	410.13002837
Formal Charge	0
FSP3	0.23
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	GVTOBQJPKSKJAC-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	116.49
Topological Polar Surface Area	59.08
Polarizability	44.49
Ring Count	3
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C22H22N2O4S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00