(5E)-5-[(2-chloro-4,5-dimethoxyphenyl)methylidene]-1-(prop-2-en-1-yl)-2-sulfanylidene-1,3-diazinane-4,6-dione

(5E)-5-[(2-chloro-4,5-dimethoxyphenyl)methylidene]-1-(prop-2-en-1-yl)-2-sulfanylidene-1,3-diazinane-4,6-dione

Formula: C16H15ClN2O4S

SMILES: COC1=C(OC)C=C(C=C2/C(=O)NC(=S)N(CC=C)C2=O)C(Cl)=C1

IUPAC: (5E)-5-[(2-chloro-4,5-dimethoxyphenyl)methylidene]-1-(prop-2-en-1-yl)-2-sulfanylidene-1,3-diazinane-4,6-dione

InChI: InChI=1S/C16H15ClN2O4S/c1-4-5-19-15(21)10(14(20)18-16(19)24)6-9-7-12(22-2)13(23-3)8-11(9)17/h4,6-8H,1,5H2,2-3H3,(H,18,20,24)/b10-6+

Composition: C (52.39%), H (4.12%), Cl (9.66%), N (7.64%), O (17.45%), S (8.74%)

Molar Mass: 366.82

Atom Count: 39

Heavy Atom Count: 24

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	366.0441058
Formal Charge	0
FSP3	0.19
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	JOMAKXRNNYHZOJ-UXBLZVDNSA-N
Lipinski's Rule of Five	1
Molar Refractivity	95.9
Topological Polar Surface Area	67.87
Polarizability	36.65
Ring Count	2
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C16H15ClN2O4S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00