N-[7-(2-chlorobenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]thiophene-2-carboxamide

N-[7-(2-chlorobenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]thiophene-2-carboxamide

Formula: C20H14ClNO4S

SMILES: ClC1=CC=CC=C1C(=O)C1=CC2=C(OCCO2)C=C1NC(=O)C1=CC=CS1

IUPAC: N-[7-(2-chlorobenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]thiophene-2-carboxamide

InChI: InChI=1S/C20H14ClNO4S/c21-14-5-2-1-4-12(14)19(23)13-10-16-17(26-8-7-25-16)11-15(13)22-20(24)18-6-3-9-27-18/h1-6,9-11H,7-8H2,(H,22,24)

Composition: C (60.08%), H (3.53%), Cl (8.87%), N (3.50%), O (16.01%), S (8.02%)

Molar Mass: 399.85

Atom Count: 41

Heavy Atom Count: 27

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	399.0332068
Formal Charge	0
FSP3	0.1
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	NZKLIQYOZBDQJH-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	104.82
Topological Polar Surface Area	64.63
Polarizability	39.5
Ring Count	4
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C20H14ClNO4S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00