2-chloro-N-[5-({[(2-ethoxyphenyl)carbamoyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]benzamide

2-chloro-N-[5-({[(2-ethoxyphenyl)carbamoyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]benzamide

Formula: C19H17ClN4O3S2

SMILES: CCOC1=CC=CC=C1NC(=O)CSC1=NN=C(NC(=O)C2=CC=CC=C2Cl)S1

IUPAC: 2-chloro-N-[5-({[(2-ethoxyphenyl)carbamoyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]benzamide

InChI: InChI=1S/C19H17ClN4O3S2/c1-2-27-15-10-6-5-9-14(15)21-16(25)11-28-19-24-23-18(29-19)22-17(26)12-7-3-4-8-13(12)20/h3-10H,2,11H2,1H3,(H,21,25)(H,22,23,26)

Composition: C (50.83%), H (3.82%), Cl (7.90%), N (12.48%), O (10.69%), S (14.28%)

Molar Mass: 448.94

Atom Count: 46

Heavy Atom Count: 29

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	448.0430605
Formal Charge	0
FSP3	0.16
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
InChIKey	QYKDBPRUYUSRSD-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	119.15
Topological Polar Surface Area	93.21
Polarizability	43.75
Ring Count	3
Rotatable Bond Count	8

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C19H17ClN4O3S2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00