3-(6-methoxy-1,3-benzothiazol-2-yl)-1-[(2E)-3-(4-methoxyphenyl)prop-2-enoyl]thiourea

3-(6-methoxy-1,3-benzothiazol-2-yl)-1-[(2E)-3-(4-methoxyphenyl)prop-2-enoyl]thiourea

Formula: C19H17N3O3S2

SMILES: COC1=CC=C(C=CC(=O)NC(=S)NC2=NC3=CC=C(OC)C=C3S2)C=C1

IUPAC: 3-(6-methoxy-1,3-benzothiazol-2-yl)-1-[(2E)-3-(4-methoxyphenyl)prop-2-enoyl]thiourea

InChI: InChI=1S/C19H17N3O3S2/c1-24-13-6-3-12(4-7-13)5-10-17(23)21-18(26)22-19-20-15-9-8-14(25-2)11-16(15)27-19/h3-11H,1-2H3,(H2,20,21,22,23,26)/b10-5+

Composition: C (57.13%), H (4.29%), N (10.52%), O (12.01%), S (16.05%)

Molar Mass: 399.48

Atom Count: 44

Heavy Atom Count: 27

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	399.071133767
Formal Charge	0
FSP3	0.11
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	BSTZQHQBTNKQKS-BJMVGYQFSA-N
Lipinski's Rule of Five	1
Molar Refractivity	111.04
Topological Polar Surface Area	72.48
Polarizability	43.15
Ring Count	3
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C19H17N3O3S2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00